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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 | CHEMBL3310833 |
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Molecular formula | C17H15Cl2N3O5S |
IUPAC name | 2,3-dichloro-N-[6-methoxy-1-(oxetan-3-yl)-2-oxo-3H-benzimidazol-5-yl]benzenesulfonamide |
Molecular weight | 444.283 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 2.2 |
Synonyms | BDBM50045261 |
Inchi Key | CXYNNGVMXXERRL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H15Cl2N3O5S/c1-26-14-6-13-11(20-17(23)22(13)9-7-27-8-9)5-12(14)21-28(24,25)15-4-2-3-10(18)16(15)19/h2-6,9,21H,7-8H2,1H3,(H,20,23) |
PubChem CID | 118706824 |
ChEMBL | CHEMBL3310833 |
IUPHAR | N/A |
BindingDB | 50045261 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 112.0 nM | PMID24909677 | BindingDB |
IC50 | 112.2 nM | PMID24909677 | ChEMBL |
Kd | <10000.0 nM | PMID24909677 | ChEMBL |
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