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Name | Mas-related G-protein coupled receptor member X1 |
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Species | Homo sapiens (Human) |
Gene | MRGPRX1 |
Synonym | Sensory neuron-specific G-protein coupled receptor 4 Sensory neuron-specific G-protein coupled receptor 3/4 MRGX1 MRGPRX1 Mrgprc11 [ Show all ] |
Disease | N/A |
Length | 322 |
Amino acid sequence | MDPTISTLDTELTPINGTEETLCYKQTLSLTVLTCIVSLVGLTGNAVVLWLLGCRMRRNAFSIYILNLAAADFLFLSGRLIYSLLSFISIPHTISKILYPVMMFSYFAGLSFLSAVSTERCLSVLWPIWYRCHRPTHLSAVVCVLLWALSLLRSILEWMLCGFLFSGADSAWCQTSDFITVAWLIFLCVVLCGSSLVLLIRILCGSRKIPLTRLYVTILLTVLVFLLCGLPFGIQFFLFLWIHVDREVLFCHVHLVSIFLSALNSSANPIIYFFVGSFRQRQNRQNLKLVLQRALQDASEVDEGGGQLPEEILELSGSRLEQ |
UniProt | Q96LB2 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q96LB2 |
3D structure model | This predicted structure model is from GPCR-EXP Q96LB2. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL5850 |
IUPHAR | 156 |
DrugBank | N/A |
Name | CHEMBL474761 |
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Molecular formula | C36H42FN7O2 |
IUPAC name | 11-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(2-piperidin-1-ylethylamino)-7-propan-2-yl-5,7-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one |
Molecular weight | 623.777 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | BDBM50413335 |
Inchi Key | ZFTADCMVGYHBIM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C36H42FN7O2/c1-24(2)33-35(45)40-30-12-9-27(38-14-17-41-15-4-3-5-16-41)23-29(30)34-39-31-22-25(6-13-32(31)44(33)34)36(46)43-20-18-42(19-21-43)28-10-7-26(37)8-11-28/h6-13,22-24,33,38H,3-5,14-21H2,1-2H3,(H,40,45) |
PubChem CID | 136233385 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50413335 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
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EC50 | 1258.93 nM | PMID19230660 | BindingDB |
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