You can:
Name | C5a anaphylatoxin chemotactic receptor 1 |
---|---|
Species | Homo sapiens (Human) |
Gene | C5AR1 |
Synonym | complement component 5a receptor 1 complement C5a receptor C5A CD88 C5R1 [ Show all ] |
Disease | Vasculitis Atopic dermatitis Inflammatory disease Rheumatoid arthritis |
Length | 350 |
Amino acid sequence | MDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVWVTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNMYASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREEYFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKTLKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIYVVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV |
UniProt | P21730 |
Protein Data Bank | 6c1r, 6c1q, 5o9h |
GPCR-HGmod model | P21730 |
3D structure model | This structure is from PDB ID 6c1r. |
BioLiP | BL0415511, BL0415514, BL0415513, BL0415512, BL0401194,BL0401195,BL0401196, |
Therapeutic Target Database | T15439 |
ChEMBL | CHEMBL2373 |
IUPHAR | 32 |
DrugBank | N/A |
Name | CHEMBL3646994 |
---|---|
Molecular formula | C29H34N4 |
IUPAC name | 4-methyl-6-(2-methyl-5-propan-2-ylphenyl)-2-(5-propan-2-yl-1H-indazol-4-yl)-7,8-dihydro-5H-1,6-naphthyridine |
Molecular weight | 438.619 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 6.8 |
Synonyms | US8846656, 41-G BDBM134562 SCHEMBL14663059 |
Inchi Key | AHVSJFJUIINJCC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H34N4/c1-17(2)21-8-7-19(5)28(14-21)33-12-11-25-24(16-33)20(6)13-27(31-25)29-22(18(3)4)9-10-26-23(29)15-30-32-26/h7-10,13-15,17-18H,11-12,16H2,1-6H3,(H,30,32) |
PubChem CID | 71240608 |
ChEMBL | CHEMBL3646994 |
IUPHAR | N/A |
BindingDB | 134562 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 3.0 nM | , None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417