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 | CHEMBL3930062 |
---|---|
Molecular formula | C23H31N5O2 |
IUPAC name | N-cyclohexyl-1-[[3-(1H-pyrazole-4-carbonylamino)phenyl]methyl]piperidine-4-carboxamide |
Molecular weight | 409.534 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 2.5 |
Synonyms | BDBM243619 US9428456, 1.044 |
Inchi Key | BGYQAFWOGYMEIA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H31N5O2/c29-22(26-20-6-2-1-3-7-20)18-9-11-28(12-10-18)16-17-5-4-8-21(13-17)27-23(30)19-14-24-25-15-19/h4-5,8,13-15,18,20H,1-3,6-7,9-12,16H2,(H,24,25)(H,26,29)(H,27,30) |
PubChem CID | 129626027 |
ChEMBL | CHEMBL3930062 |
IUPHAR | N/A |
BindingDB | 243619 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 1240.0 nM | , None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417