CGBVS予測モデルタンパクリストGPCR

予測モデルを選択:

モデル情報:

STDHA
標的タンパク数263259
学習データ数183007192503
*STD = Standard Model, HA = High Activity Model

相互作用(リガンド)データ数 ◎:500~、○:100~499、△:1~99、x:0

UniProt IDAccessionProtein NameStandard ModelHigh Activity Model
5HT1A_HUMANP089085-hydroxytryptamine receptor 1A
5HT1B_HUMANP282225-hydroxytryptamine receptor 1B
5HT1D_HUMANP282215-hydroxytryptamine receptor 1D
5HT1E_HUMANP285665-hydroxytryptamine receptor 1E
5HT1F_HUMANP309395-hydroxytryptamine receptor 1F
5HT2A_HUMANP282235-hydroxytryptamine receptor 2A
5HT2B_HUMANP415955-hydroxytryptamine receptor 2B
5HT2C_HUMANP283355-hydroxytryptamine receptor 2C
5HT4R_HUMANQ136395-hydroxytryptamine receptor 4
5HT5A_HUMANP478985-hydroxytryptamine receptor 5A
5HT6R_HUMANP504065-hydroxytryptamine receptor 6
5HT7R_HUMANP349695-hydroxytryptamine receptor 7
AA1R_HUMANP30542Adenosine receptor A1
AA2AR_HUMANP29274Adenosine receptor A2a
AA2BR_HUMANP29275Adenosine receptor A2b
AA3R_HUMANP0DMS8Adenosine receptor A3
ACKR3_HUMANP25106Atypical chemokine receptor 3
ACM1_HUMANP11229Muscarinic acetylcholine receptor M1
ACM2_HUMANP08172Muscarinic acetylcholine receptor M2
ACM3_HUMANP20309Muscarinic acetylcholine receptor M3
ACM4_HUMANP08173Muscarinic acetylcholine receptor M4
ACM5_HUMANP08912Muscarinic acetylcholine receptor M5
ADA1A_HUMANP35348Alpha-1A adrenergic receptor
ADA1B_HUMANP35368Alpha-1B adrenergic receptor
ADA1D_HUMANP25100Alpha-1D adrenergic receptor
ADA2A_HUMANP08913Alpha-2A adrenergic receptor
ADA2B_HUMANP18089Alpha-2B adrenergic receptor
ADA2C_HUMANP18825Alpha-2C adrenergic receptor
ADRB1_HUMANP08588Beta-1 adrenergic receptor
ADRB2_HUMANP07550Beta-2 adrenergic receptor
ADRB3_HUMANP13945Beta-3 adrenergic receptor
AGTR1_HUMANP30556Type-1 angiotensin II receptor
AGTR2_HUMANP50052Type-2 angiotensin II receptor
APJ_HUMANP35414Apelin receptor
BKRB1_HUMANP46663B1 bradykinin receptor
BKRB2_HUMANP30411B2 bradykinin receptor
BRS3_HUMANP32247Bombesin receptor subtype-3
C3AR_HUMANQ16581C3a anaphylatoxin chemotactic receptor
C5AR1_HUMANP21730C5a anaphylatoxin chemotactic receptor 1
C5AR2_HUMANQ9P296C5a anaphylatoxin chemotactic receptor 2×
CALCR_HUMANP30988Calcitonin receptor
CALRL_HUMANQ16602Calcitonin gene-related peptide type 1 receptor
CASR_HUMANP41180Extracellular calcium-sensing receptor
CCKAR_HUMANP32238Cholecystokinin receptor type A
CCR10_HUMANP46092C-C chemokine receptor type 10
CCR1_HUMANP32246C-C chemokine receptor type 1
CCR2_HUMANP41597C-C chemokine receptor type 2
CCR3_HUMANP51677C-C chemokine receptor type 3
CCR4_HUMANP51679C-C chemokine receptor type 4
CCR5_HUMANP51681C-C chemokine receptor type 5
CCR6_HUMANP51684C-C chemokine receptor type 6
CCR7_HUMANP32248C-C chemokine receptor type 7
CCR8_HUMANP51685C-C chemokine receptor type 8
CCR9_HUMANP51686C-C chemokine receptor type 9
CCRL2_HUMANO00421C-C chemokine receptor-like 2
CLTR1_HUMANQ9Y271Cysteinyl leukotriene receptor 1
CLTR2_HUMANQ9NS75Cysteinyl leukotriene receptor 2
CML1_HUMANQ99788Chemerin-like receptor 1
CNR1_HUMANP21554Cannabinoid receptor 1
CNR2_HUMANP34972Cannabinoid receptor 2
CRFR1_HUMANP34998Corticotropin-releasing factor receptor 1
CRFR2_HUMANQ13324Corticotropin-releasing factor receptor 2
CX3C1_HUMANP49238CX3C chemokine receptor 1
CXCR1_HUMANP25024C-X-C chemokine receptor type 1
CXCR2_HUMANP25025C-X-C chemokine receptor type 2
CXCR3_HUMANP49682C-X-C chemokine receptor type 3
CXCR4_HUMANP61073C-X-C chemokine receptor type 4
CXCR5_HUMANP32302C-X-C chemokine receptor type 5
CXCR6_HUMANO00574C-X-C chemokine receptor type 6
DRD1_HUMANP21728D(1A) dopamine receptor
DRD2_HUMANP14416D(2) dopamine receptor
DRD3_HUMANP35462D(3) dopamine receptor
DRD4_HUMANP21917D(4) dopamine receptor
DRD5_HUMANP21918D(1B) dopamine receptor
EDNRA_HUMANP25101Endothelin-1 receptor
EDNRB_HUMANP24530Endothelin receptor type B
FFAR1_HUMANO14842Free fatty acid receptor 1
FFAR2_HUMANO15552Free fatty acid receptor 2
FFAR3_HUMANO14843Free fatty acid receptor 3
FFAR4_HUMANQ5NUL3Free fatty acid receptor 4
FPR1_HUMANP21462fMet-Leu-Phe receptor
FPR2_HUMANP25090N-formyl peptide receptor 2
FSHR_HUMANP23945Follicle-stimulating hormone receptor
GABR1_HUMANQ9UBS5Gamma-aminobutyric acid type B receptor subunit 1
GABR2_HUMANO75899Gamma-aminobutyric acid type B receptor subunit 2
GALR1_HUMANP47211Galanin receptor type 1
GALR2_HUMANO43603Galanin receptor type 2
GALR3_HUMANO60755Galanin receptor type 3
GASR_HUMANP32239Gastrin/cholecystokinin type B receptor
GHRHR_HUMANQ02643Growth hormone-releasing hormone receptor
GHSR_HUMANQ92847Growth hormone secretagogue receptor type 1
GIPR_HUMANP48546Gastric inhibitory polypeptide receptor
GLP1R_HUMANP43220Glucagon-like peptide 1 receptor
GLR_HUMANP47871Glucagon receptor
GNRHR_HUMANP30968Gonadotropin-releasing hormone receptor
GP119_HUMANQ8TDV5Glucose-dependent insulinotropic receptor
GP139_HUMANQ6DWJ6Probable G-protein coupled receptor 139
GP142_HUMANQ7Z601Probable G-protein coupled receptor 142
GP174_HUMANQ9BXC1Probable G-protein coupled receptor 174
GP183_HUMANP32249G-protein coupled receptor 183
GPBAR_HUMANQ8TDU6G-protein coupled bile acid receptor 1
GPER1_HUMANQ99527G-protein coupled estrogen receptor 1
GPR15_HUMANP49685G-protein coupled receptor 15
GPR17_HUMANQ13304Uracil nucleotide/cysteinyl leukotriene receptor
GPR18_HUMANQ14330N-arachidonyl glycine receptor
GPR27_HUMANQ9NS67Probable G-protein coupled receptor 27
GPR34_HUMANQ9UPC5Probable G-protein coupled receptor 34
GPR35_HUMANQ9HC97G-protein coupled receptor 35
GPR39_HUMANO43194G-protein coupled receptor 39
GPR4_HUMANP46093G-protein coupled receptor 4
GPR52_HUMANQ9Y2T5G-protein coupled receptor 52
GPR55_HUMANQ9Y2T6G-protein coupled receptor 55
GPR6_HUMANP46095G-protein coupled receptor 6
GPR84_HUMANQ9NQS5G-protein coupled receptor 84
GPR88_HUMANQ9GZN0Probable G-protein coupled receptor 88
GRM1_HUMANQ13255Metabotropic glutamate receptor 1
GRM2_HUMANQ14416Metabotropic glutamate receptor 2
GRM3_HUMANQ14832Metabotropic glutamate receptor 3
GRM4_HUMANQ14833Metabotropic glutamate receptor 4
GRM5_HUMANP41594Metabotropic glutamate receptor 5
GRM6_HUMANO15303Metabotropic glutamate receptor 6
GRM7_HUMANQ14831Metabotropic glutamate receptor 7
GRM8_HUMANO00222Metabotropic glutamate receptor 8
GRPR_HUMANP30550Gastrin-releasing peptide receptor
HCAR1_HUMANQ9BXC0Hydroxycarboxylic acid receptor 1
HCAR2_HUMANQ8TDS4Hydroxycarboxylic acid receptor 2
HCAR3_HUMANP49019Hydroxycarboxylic acid receptor 3
HRH1_HUMANP35367Histamine H1 receptor
HRH2_HUMANP25021Histamine H2 receptor
HRH3_HUMANQ9Y5N1Histamine H3 receptor
HRH4_HUMANQ9H3N8Histamine H4 receptor
KISSR_HUMANQ969F8KiSS-1 receptor
LPAR1_HUMANQ92633Lysophosphatidic acid receptor 1
LPAR2_HUMANQ9HBW0Lysophosphatidic acid receptor 2
LPAR3_HUMANQ9UBY5Lysophosphatidic acid receptor 3
LPAR4_HUMANQ99677Lysophosphatidic acid receptor 4
LPAR5_HUMANQ9H1C0Lysophosphatidic acid receptor 5
LPAR6_HUMANP43657Lysophosphatidic acid receptor 6
LSHR_HUMANP22888Lutropin-choriogonadotropic hormone receptor
LT4R1_HUMANQ15722Leukotriene B4 receptor 1
LT4R2_HUMANQ9NPC1Leukotriene B4 receptor 2
MAS_HUMANP04201Proto-oncogene Mas
MC3R_HUMANP41968Melanocortin receptor 3
MC4R_HUMANP32245Melanocortin receptor 4
MC5R_HUMANP33032Melanocortin receptor 5
MCHR1_HUMANQ99705Melanin-concentrating hormone receptor 1
MCHR2_HUMANQ969V1Melanin-concentrating hormone receptor 2
MRGX1_HUMANQ96LB2Mas-related G-protein coupled receptor member X1
MRGX2_HUMANQ96LB1Mas-related G-protein coupled receptor member X2
MRGX4_HUMANQ96LA9Mas-related G-protein coupled receptor member X4
MSHR_HUMANQ01726Melanocyte-stimulating hormone receptor
MTLR_HUMANO43193Motilin receptor
MTR1A_HUMANP48039Melatonin receptor type 1A
MTR1B_HUMANP49286Melatonin receptor type 1B
NK1R_HUMANP25103Substance-P receptor
NK2R_HUMANP21452Substance-K receptor
NK3R_HUMANP29371Neuromedin-K receptor
NMBR_HUMANP28336Neuromedin-B receptor
NMUR1_HUMANQ9HB89Neuromedin-U receptor 1
NMUR2_HUMANQ9GZQ4Neuromedin-U receptor 2
NPBW1_HUMANP48145Neuropeptides B/W receptor type 1
NPFF1_HUMANQ9GZQ6Neuropeptide FF receptor 1
NPFF2_HUMANQ9Y5X5Neuropeptide FF receptor 2
NPSR1_HUMANQ6W5P4Neuropeptide S receptor
NPY1R_HUMANP25929Neuropeptide Y receptor type 1
NPY2R_HUMANP49146Neuropeptide Y receptor type 2
NPY4R_HUMANP50391Neuropeptide Y receptor type 4
NPY5R_HUMANQ15761Neuropeptide Y receptor type 5
NTR1_HUMANP30989Neurotensin receptor type 1
NTR2_HUMANO95665Neurotensin receptor type 2
O51E2_HUMANQ9H255Olfactory receptor 51E2
OGR1_HUMANQ15743Ovarian cancer G-protein coupled receptor 1
OPRD_HUMANP41143Delta-type opioid receptor
OPRK_HUMANP41145Kappa-type opioid receptor
OPRM_HUMANP35372Mu-type opioid receptor
OPRX_HUMANP41146Nociceptin receptor
OX1R_HUMANO43613Orexin/Hypocretin receptor type 1
OX2R_HUMANO43614Orexin receptor type 2
OXER1_HUMANQ8TDS5Oxoeicosanoid receptor 1
OXGR1_HUMANQ96P682-oxoglutarate receptor 1×
OXYR_HUMANP30559Oxytocin receptor
P2RY1_HUMANP47900P2Y purinoceptor 1
P2RY2_HUMANP41231P2Y purinoceptor 2
P2RY4_HUMANP51582P2Y purinoceptor 4
P2RY6_HUMANQ15077P2Y purinoceptor 6
P2Y10_HUMANO00398Putative P2Y purinoceptor 10
P2Y11_HUMANQ96G91P2Y purinoceptor 11
P2Y12_HUMANQ9H244P2Y purinoceptor 12
P2Y13_HUMANQ9BPV8P2Y purinoceptor 13
P2Y14_HUMANQ15391P2Y purinoceptor 14
PACR_HUMANP41586Pituitary adenylate cyclase-activating polypeptide type I re
PAR1_HUMANP25116Proteinase-activated receptor 1
PAR2_HUMANP55085Proteinase-activated receptor 2
PAR4_HUMANQ96RI0Proteinase-activated receptor 4
PD2R2_HUMANQ9Y5Y4Prostaglandin D2 receptor 2
PD2R_HUMANQ13258Prostaglandin D2 receptor
PE2R1_HUMANP34995Prostaglandin E2 receptor EP1 subtype
PE2R2_HUMANP43116Prostaglandin E2 receptor EP2 subtype
PE2R3_HUMANP43115Prostaglandin E2 receptor EP3 subtype
PE2R4_HUMANP35408Prostaglandin E2 receptor EP4 subtype
PF2R_HUMANP43088Prostaglandin F2-alpha receptor
PI2R_HUMANP43119Prostacyclin receptor
PKR1_HUMANQ8TCW9Prokineticin receptor 1
PKR2_HUMANQ8NFJ6Prokineticin receptor 2×
PRLHR_HUMANP49683Prolactin-releasing peptide receptor
PTAFR_HUMANP25105Platelet-activating factor receptor
PTH1R_HUMANQ03431Parathyroid hormone/parathyroid hormone-related peptide rece
QRFPR_HUMANQ96P65Pyroglutamylated RF-amide peptide receptor
RL3R1_HUMANQ9NSD7Relaxin-3 receptor 1
RL3R2_HUMANQ8TDU9Relaxin-3 receptor 2
RXFP1_HUMANQ9HBX9Relaxin receptor 1
RXFP2_HUMANQ8WXD0Relaxin receptor 2
S1PR1_HUMANP21453Sphingosine 1-phosphate receptor 1
S1PR2_HUMANO95136Sphingosine 1-phosphate receptor 2
S1PR3_HUMANQ99500Sphingosine 1-phosphate receptor 3
S1PR4_HUMANO95977Sphingosine 1-phosphate receptor 4
S1PR5_HUMANQ9H228Sphingosine 1-phosphate receptor 5
SMO_HUMANQ99835Protein smoothened
SSR1_HUMANP30872Somatostatin receptor type 1
SSR2_HUMANP30874Somatostatin receptor type 2
SSR3_HUMANP32745Somatostatin receptor type 3
SSR4_HUMANP31391Somatostatin receptor type 4
SSR5_HUMANP35346Somatostatin receptor type 5
SUCR1_HUMANQ9BXA5Succinate receptor 1
T2R10_HUMANQ9NYW0Taste receptor type 2 member 10
T2R13_HUMANQ9NYV9Taste receptor type 2 member 13
T2R14_HUMANQ9NYV8Taste receptor type 2 member 14
T2R16_HUMANQ9NYV7Taste receptor type 2 member 16
T2R19_HUMANP59542Taste receptor type 2 member 19
T2R20_HUMANP59543Taste receptor type 2 member 20
T2R30_HUMANP59541Taste receptor type 2 member 30
T2R31_HUMANP59538Taste receptor type 2 member 31
T2R38_HUMANP59533Taste receptor type 2 member 38
T2R39_HUMANP59534Taste receptor type 2 member 39
T2R40_HUMANP59535Taste receptor type 2 member 40
T2R41_HUMANP59536Taste receptor type 2 member 41
T2R42_HUMANQ7RTR8Taste receptor type 2 member 42
T2R43_HUMANP59537Taste receptor type 2 member 43
T2R45_HUMANP59539Taste receptor type 2 member 45
T2R46_HUMANP59540Taste receptor type 2 member 46
T2R50_HUMANP59544Taste receptor type 2 member 50
T2R60_HUMANP59551Taste receptor type 2 member 60
TA2R1_HUMANQ9NYW7Taste receptor type 2 member 1
TA2R3_HUMANQ9NYW6Taste receptor type 2 member 3
TA2R4_HUMANQ9NYW5Taste receptor type 2 member 4
TA2R5_HUMANQ9NYW4Taste receptor type 2 member 5
TA2R7_HUMANQ9NYW3Taste receptor type 2 member 7
TA2R8_HUMANQ9NYW2Taste receptor type 2 member 8
TA2R9_HUMANQ9NYW1Taste receptor type 2 member 9
TA2R_HUMANP21731Thromboxane A2 receptor
TAAR1_HUMANQ96RJ0Trace amine-associated receptor 1
TAAR5_HUMANO14804Trace amine-associated receptor 5×
TRFR_HUMANP34981Thyrotropin-releasing hormone receptor
TS1R1_HUMANQ7RTX1Taste receptor type 1 member 1
TS1R2_HUMANQ8TE23Taste receptor type 1 member 2
TS1R3_HUMANQ7RTX0Taste receptor type 1 member 3
TSHR_HUMANP16473Thyrotropin receptor
UR2R_HUMANQ9UKP6Urotensin-2 receptor
V1AR_HUMANP37288Vasopressin V1a receptor
V1BR_HUMANP47901Vasopressin V1b receptor
V2R_HUMANP30518Vasopressin V2 receptor
VIPR1_HUMANP32241Vasoactive intestinal polypeptide receptor 1
VIPR2_HUMANP41587Vasoactive intestinal polypeptide receptor 2
Total target proteins:263259

CGBVSでAUROCが0.7以上を期待できるオーファンターゲット(※ ChEMBL34モデルによるデータです)

UniProt IDAccessionProtein Name
ACTHR_HUMANQ01718Adrenocorticotropic hormone receptor
FPR3_HUMANP25089N-formyl peptide receptor 3
GLP2R_HUMANO95838Glucagon-like peptide 2 receptor
NPBW2_HUMANP48146Neuropeptides B/W receptor type 2
PTH2R_HUMANP49190Parathyroid hormone 2 receptor
SCTR_HUMANP47872Secretin receptor
VIPR1_HUMANP32241Vasoactive intestinal polypeptide receptor 1
Total target proteins: 7

関連文献:
1) Kawasaki, E., Kanai, C., & Yoshimori, A. (2024). Applicability of the CGBVS Method in Predicting Ligands for Orphan Targets. Poster Presentation at the 41st Medicinal Chemistry Symposium (November 2024). (MCS2024 Poster)
2) Kanai, C., Kawasaki, E., Murakami, R., Morita, Y., & Yoshimori, A. (2021). Computational Prediction of Compound–Protein Interactions for Orphan Targets Using CGBVS. Molecules, 26(17), 5131. (https://doi.org/10.3390/molecules26175131)

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