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Name | C-C chemokine receptor type 8 |
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Species | Homo sapiens (Human) |
Gene | CCR8 |
Synonym | GPRCY6 GPR-CY6 CMKBRL2 CKR-L1 ChemR1 [ Show all ] |
Disease | Psoriasis |
Length | 355 |
Amino acid sequence | MDYTLDLSVTTVTDYYYPDIFSSPCDAELIQTNGKLLLAVFYCLLFVFSLLGNSLVILVLVVCKKLRSITDVYLLNLALSDLLFVFSFPFQTYYLLDQWVFGTVMCKVVSGFYYIGFYSSMFFITLMSVDRYLAVVHAVYALKVRTIRMGTTLCLAVWLTAIMATIPLLVFYQVASEDGVLQCYSFYNQQTLKWKIFTNFKMNILGLLIPFTIFMFCYIKILHQLKRCQNHNKTKAIRLVLIVVIASLLFWVPFNVVLFLTSLHSMHILDGCSISQQLTYATHVTEIISFTHCCVNPVIYAFVGEKFKKHLSEIFQKSCSQIFNYLGRQMPRESCEKSSSCQQHSSRSSSVDYIL |
UniProt | P51685 |
Protein Data Bank | N/A |
GPCR-HGmod model | P51685 |
3D structure model | This predicted structure model is from GPCR-EXP P51685. |
BioLiP | N/A |
Therapeutic Target Database | T20575 |
ChEMBL | CHEMBL4596 |
IUPHAR | 65 |
DrugBank | N/A |
Name | CHEMBL245568 |
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Molecular formula | C27H28N4O3 |
IUPAC name | (5R)-3-[1-(1H-indol-2-ylmethyl)piperidin-4-yl]-5-(6-methoxyquinolin-4-yl)-1,3-oxazolidin-2-one |
Molecular weight | 456.546 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.9 |
Synonyms | BDBM50423246 SB-649701 |
Inchi Key | CUWYXEKZVGDQDJ-SANMLTNESA-N |
Inchi ID | InChI=1S/C27H28N4O3/c1-33-21-6-7-25-23(15-21)22(8-11-28-25)26-17-31(27(32)34-26)20-9-12-30(13-10-20)16-19-14-18-4-2-3-5-24(18)29-19/h2-8,11,14-15,20,26,29H,9-10,12-13,16-17H2,1H3/t26-/m0/s1 |
PubChem CID | 16112836 |
ChEMBL | CHEMBL245568 |
IUPHAR | N/A |
BindingDB | 50423246 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 19.95 nM | PMID17267215 | ChEMBL |
IC50 | 20.0 nM | PMID17267215 | BindingDB |
IC50 | 25.0 nM | PMID17267215 | BindingDB |
IC50 | 100.0 nM | PMID17267215 | BindingDB,ChEMBL |
IC50 | 501.0 nM | PMID17267215 | BindingDB |
IC50 | 501.19 nM | PMID17267215 | ChEMBL |
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