You can:
Name | Atypical chemokine receptor 3 |
---|---|
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 | CHEMBL3899145 |
---|---|
Molecular formula | C25H34N4O2 |
IUPAC name | N-[3-[[4-(tert-butylcarbamoyl)piperidin-1-yl]methyl]-5-methylphenyl]-5-methylpyridine-3-carboxamide |
Molecular weight | 422.573 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 3.0 |
Synonyms | BDBM243696 US9428456, 1.317 |
Inchi Key | BWTWGWJBTWUAQM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H34N4O2/c1-17-10-19(13-22(12-17)27-23(30)21-11-18(2)14-26-15-21)16-29-8-6-20(7-9-29)24(31)28-25(3,4)5/h10-15,20H,6-9,16H2,1-5H3,(H,27,30)(H,28,31) |
PubChem CID | 129626082 |
ChEMBL | CHEMBL3899145 |
IUPHAR | N/A |
BindingDB | 243696 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 76.0 nM | , None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218