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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 | CHEMBL3923474 |
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Molecular formula | C30H41N5O2 |
IUPAC name | N-[3-[1-[4-(cyclohexylcarbamoyl)piperidin-1-yl]ethyl]phenyl]-5-pyrrolidin-1-ylpyridine-2-carboxamide |
Molecular weight | 503.691 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.4 |
Synonyms | BDBM243666 US9428456, 1.188 |
Inchi Key | CRVQMWXEIODKSL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H41N5O2/c1-22(34-18-14-23(15-19-34)29(36)32-25-9-3-2-4-10-25)24-8-7-11-26(20-24)33-30(37)28-13-12-27(21-31-28)35-16-5-6-17-35/h7-8,11-13,20-23,25H,2-6,9-10,14-19H2,1H3,(H,32,36)(H,33,37) |
PubChem CID | 129626061 |
ChEMBL | CHEMBL3923474 |
IUPHAR | N/A |
BindingDB | 243666 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 215.0 nM | , None | BindingDB,ChEMBL |
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