You can:
Name | C-X-C chemokine receptor type 3 |
---|---|
Species | Homo sapiens (Human) |
Gene | CXCR3 |
Synonym | MigR IP-10 receptor Interferon-inducible protein 10 receptor GPR9 G protein-coupled receptor 9 [ Show all ] |
Disease | Inflammatory disease Autoimmune diabetes Inflammatory disorder Rheumatoid arthritis Psoriatic disorder |
Length | 368 |
Amino acid sequence | MVLEVSDHQVLNDAEVAALLENFSSSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLFLLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVLTLPLWAVDAAVQWVFGSGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCLLFALPDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRLRAMRLVVVVVVAFALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTSGLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGLQRQPSSSRRDSSWSETSEASYSGL |
UniProt | P49682 |
Protein Data Bank | N/A |
GPCR-HGmod model | P49682 |
3D structure model | This predicted structure model is from GPCR-EXP P49682. |
BioLiP | N/A |
Therapeutic Target Database | T25315 |
ChEMBL | CHEMBL4441 |
IUPHAR | 70 |
DrugBank | N/A |
Name | CHEMBL1809027 |
---|---|
Molecular formula | C25H30N4O2 |
IUPAC name | (6aR,9R)-N-cyclopentyl-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide |
Molecular weight | 418.541 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 2 |
XlogP | 2.5 |
Synonyms | BDBM50349684 |
Inchi Key | WTAYQRJTVWIWEB-VGOFRKELSA-N |
Inchi ID | InChI=1S/C25H30N4O2/c30-24(28-10-3-4-11-28)17-12-20-19-8-5-9-21-23(19)16(14-26-21)13-22(20)29(15-17)25(31)27-18-6-1-2-7-18/h5,8-9,12,14,17-18,22,26H,1-4,6-7,10-11,13,15H2,(H,27,31)/t17-,22-/m1/s1 |
PubChem CID | 56673941 |
ChEMBL | CHEMBL1809027 |
IUPHAR | N/A |
BindingDB | 50349684 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 73.0 nM | PMID21764306 | BindingDB,ChEMBL |
IC50 | 160.0 nM | PMID21764306 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218