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Name | Atypical chemokine receptor 3 |
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Species | Homo sapiens (Human) |
Gene | ACKR3 |
Synonym | RDC-1 GPR159 G-protein coupled receptor RDC1 homolog G-protein coupled receptor 159 Cxcr7 [ Show all ] |
Disease | Cancer Asthma |
Length | 362 |
Amino acid sequence | MDLHLFDYSEPGNFSDISWPCNSSDCIVVDTVMCPNMPNKSVLLYTLSFIYIFIFVIGMIANSVVVWVNIQAKTTGYDTHCYILNLAIADLWVVLTIPVWVVSLVQHNQWPMGELTCKVTHLIFSINLFGSIFFLTCMSVDRYLSITYFTNTPSSRKKMVRRVVCILVWLLAFCVSLPDTYYLKTVTSASNNETYCRSFYPEHSIKEWLIGMELVSVVLGFAVPFSIIAVFYFLLARAISASSDQEKHSSRKIIFSYVVVFLVCWLPYHVAVLLDIFSILHYIPFTCRLEHALFTALHVTQCLSLVHCCVNPVLYSFINRNYRYELMKAFIFKYSAKTGLTKLIDASRVSETEYSALEQSTK |
UniProt | P25106 |
Protein Data Bank | N/A |
GPCR-HGmod model | P25106 |
3D structure model | This predicted structure model is from GPCR-EXP P25106. |
BioLiP | N/A |
Therapeutic Target Database | T10491 |
ChEMBL | CHEMBL2010631 |
IUPHAR | 80 |
DrugBank | N/A |
Name | CHEMBL3914298 |
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Molecular formula | C27H34ClN3O3 |
IUPAC name | 1-[[4-chloro-3-[(4-methoxybenzoyl)amino]phenyl]methyl]-N-cyclohexylpiperidine-4-carboxamide |
Molecular weight | 484.037 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.8 |
Synonyms | BDBM243544 US9428456, 1.159 |
Inchi Key | CHTUGYYYIYYEIG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H34ClN3O3/c1-34-23-10-8-20(9-11-23)27(33)30-25-17-19(7-12-24(25)28)18-31-15-13-21(14-16-31)26(32)29-22-5-3-2-4-6-22/h7-12,17,21-22H,2-6,13-16,18H2,1H3,(H,29,32)(H,30,33) |
PubChem CID | 129625978 |
ChEMBL | CHEMBL3914298 |
IUPHAR | N/A |
BindingDB | 243544 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 14.0 nM | , None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218