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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 | CHEMBL3956018 |
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Molecular formula | C27H34FN3O2 |
IUPAC name | N-cyclohexyl-1-[[3-[(2-fluoro-5-methylbenzoyl)amino]phenyl]methyl]piperidine-4-carboxamide |
Molecular weight | 451.586 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 4.6 |
Synonyms | US9428456, 1.116 BDBM243878 |
Inchi Key | DIECZNKEYJZXHK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H34FN3O2/c1-19-10-11-25(28)24(16-19)27(33)30-23-9-5-6-20(17-23)18-31-14-12-21(13-15-31)26(32)29-22-7-3-2-4-8-22/h5-6,9-11,16-17,21-22H,2-4,7-8,12-15,18H2,1H3,(H,29,32)(H,30,33) |
PubChem CID | 72705979 |
ChEMBL | CHEMBL3956018 |
IUPHAR | N/A |
BindingDB | 243878 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 6.0 nM | , None | BindingDB,ChEMBL |
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