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Name | C-C chemokine receptor type 4 |
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Species | Homo sapiens (Human) |
Gene | CCR4 |
Synonym | K5-5 ChemR13 chemokine (C-C motif) receptor 4 CD194 CCR4 [ Show all ] |
Disease | Asthma Atopic dermatitis Autoimmune diabetes |
Length | 360 |
Amino acid sequence | MNPTDIADTTLDESIYSNYYLYESIPKPCTKEGIKAFGELFLPPLYSLVFVFGLLGNSVVVLVLFKYKRLRSMTDVYLLNLAISDLLFVFSLPFWGYYAADQWVFGLGLCKMISWMYLVGFYSGIFFVMLMSIDRYLAIVHAVFSLRARTLTYGVITSLATWSVAVFASLPGFLFSTCYTERNHTYCKTKYSLNSTTWKVLSSLEINILGLVIPLGIMLFCYSMIIRTLQHCKNEKKNKAVKMIFAVVVLFLGFWTPYNIVLFLETLVELEVLQDCTFERYLDYAIQATETLAFVHCCLNPIIYFFLGEKFRKYILQLFKTCRGLFVLCQYCGLLQIYSADTPSSSYTQSTMDHDLHDAL |
UniProt | P51679 |
Protein Data Bank | N/A |
GPCR-HGmod model | P51679 |
3D structure model | This predicted structure model is from GPCR-EXP P51679. |
BioLiP | N/A |
Therapeutic Target Database | T06955 |
ChEMBL | CHEMBL2414 |
IUPHAR | 61 |
DrugBank | N/A |
Name | CHEMBL297335 |
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Molecular formula | C29H31Cl2N3O3S |
IUPAC name | 2-[(2R,5R)-2-(2,4-dichlorophenyl)-3-(3-morpholin-4-ylpropyl)-4-oxo-1,3-thiazolidin-5-yl]-N-(naphthalen-1-ylmethyl)acetamide |
Molecular weight | 572.545 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.1 |
Synonyms | BDBM50142366 2-[(2R,5R)-2-(2,4-Dichloro-phenyl)-3-(3-morpholin-4-yl-propyl)-4-oxo-thiazolidin-5-yl]-N-naphthalen-1-ylmethyl-acetamide |
Inchi Key | CVMYBVZPBADLDU-GGXMVOPNSA-N |
Inchi ID | InChI=1S/C29H31Cl2N3O3S/c30-22-9-10-24(25(31)17-22)29-34(12-4-11-33-13-15-37-16-14-33)28(36)26(38-29)18-27(35)32-19-21-7-3-6-20-5-1-2-8-23(20)21/h1-3,5-10,17,26,29H,4,11-16,18-19H2,(H,32,35)/t26-,29-/m1/s1 |
PubChem CID | 44288779 |
ChEMBL | CHEMBL297335 |
IUPHAR | N/A |
BindingDB | 50142366 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 33000.0 nM | PMID15026036 | BindingDB,ChEMBL |
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