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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 | CHEMBL3982357 |
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Molecular formula | C25H32FN3O3 |
IUPAC name | N-tert-butyl-1-[[5-[(4-fluorobenzoyl)amino]-2-methoxyphenyl]methyl]piperidine-4-carboxamide |
Molecular weight | 441.547 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 3.4 |
Synonyms | BDBM243677 US9428456, 1.298 |
Inchi Key | CTWDLNAUIDFXSL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H32FN3O3/c1-25(2,3)28-24(31)18-11-13-29(14-12-18)16-19-15-21(9-10-22(19)32-4)27-23(30)17-5-7-20(26)8-6-17/h5-10,15,18H,11-14,16H2,1-4H3,(H,27,30)(H,28,31) |
PubChem CID | 129626069 |
ChEMBL | CHEMBL3982357 |
IUPHAR | N/A |
BindingDB | 243677 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 19.0 nM | , None | BindingDB,ChEMBL |
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