You can:
Name | C-C chemokine receptor type 1 |
---|---|
Species | Homo sapiens (Human) |
Gene | CCR1 |
Synonym | macrophage inflammatory protein-1 alpha receptor MIP-1alpha-R MIP-1alpha/RANTES MIP-1alphaR MIP1aR [ Show all ] |
Disease | Autoimmune diabetes Rheumatoid arthritis Chronic obstructive pulmonary disease |
Length | 355 |
Amino acid sequence | METPNTTEDYDTTTEFDYGDATPCQKVNERAFGAQLLPPLYSLVFVIGLVGNILVVLVLVQYKRLKNMTSIYLLNLAISDLLFLFTLPFWIDYKLKDDWVFGDAMCKILSGFYYTGLYSEIFFIILLTIDRYLAIVHAVFALRARTVTFGVITSIIIWALAILASMPGLYFSKTQWEFTHHTCSLHFPHESLREWKLFQALKLNLFGLVLPLLVMIICYTGIIKILLRRPNEKKSKAVRLIFVIMIIFFLFWTPYNLTILISVFQDFLFTHECEQSRHLDLAVQVTEVIAYTHCCVNPVIYAFVGERFRKYLRQLFHRRVAVHLVKWLPFLSVDRLERVSSTSPSTGEHELSAGF |
UniProt | P32246 |
Protein Data Bank | N/A |
GPCR-HGmod model | P32246 |
3D structure model | This predicted structure model is from GPCR-EXP P32246. |
BioLiP | N/A |
Therapeutic Target Database | T16016 |
ChEMBL | CHEMBL2413 |
IUPHAR | 58 |
DrugBank | N/A |
Name | CHEMBL422115 |
---|---|
Molecular formula | C26H34N2O |
IUPAC name | 5-(4-butyl-4-hydroxypiperidin-1-yl)-2,2-diphenylpentanenitrile |
Molecular weight | 390.571 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | 2,2-Diphenyl-5-(4-hydroxy-4-butylpiperidino)valeronitrile BDBM50027203 SCHEMBL9105073 5-(4-Butyl-4-hydroxy-piperidin-1-yl)-2,2-diphenyl-pentanenitrile |
Inchi Key | XQJJPORTUWZGIY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H34N2O/c1-2-3-15-25(29)17-20-28(21-18-25)19-10-16-26(22-27,23-11-6-4-7-12-23)24-13-8-5-9-14-24/h4-9,11-14,29H,2-3,10,15-21H2,1H3 |
PubChem CID | 10524463 |
ChEMBL | CHEMBL422115 |
IUPHAR | N/A |
BindingDB | 50027203 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 4010.0 nM | PMID10579830 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218