Reaction Details Report a problem with these data
Target
C-C chemokine receptor type 4
Ligand
BDBM50175665
Substrate
n/a
Meas. Tech.
ChEMBL_329115 (CHEMBL863431)
IC50
10±n/a nM
Citation
 Purandare, AV; Wan, H; Gao, A; Somerville, J; Burke, C; Vaccaro, W; Yang, X; McIntyre, KW; Poss, MA Optimization of CCR4 antagonists: side-chain exploration. Bioorg Med Chem Lett 16:204-7 (2005) [PubMed]  Article 
Target
Name:
C-C chemokine receptor type 4
Synonyms:
C-C CKR-4 | C-C chemokine receptor type 4 | C-C chemokine receptor type 4 (CCR4) | CC-CKR-4 | CCR-4 | CCR4 | CCR4_HUMAN | CD_antigen=CD194 | CMKBR4 | K5-5
Type:
Enzyme
Mol. Mass.:
41406.41
Organism:
Homo sapiens (Human)
Description:
P51679
Residue:
360
Sequence:
MNPTDIADTTLDESIYSNYYLYESIPKPCTKEGIKAFGELFLPPLYSLVFVFGLLGNSVVVLVLFKYKRLRSMTDVYLLNLAISDLLFVFSLPFWGYYAADQWVFGLGLCKMISWMYLVGFYSGIFFVMLMSIDRYLAIVHAVFSLRARTLTYGVITSLATWSVAVFASLPGFLFSTCYTERNHTYCKTKYSLNSTTWKVLSSLEINILGLVIPLGIMLFCYSMIIRTLQHCKNEKKNKAVKMIFAVVVLFLGFWTPYNIVLFLETLVELEVLQDCTFERYLDYAIQATETLAFVHCCLNPIIYFFLGEKFRKYILQLFKTCRGLFVLCQYCGLLQIYSADTPSSSYTQSTMDHDLHDAL
  
Inhibitor
Name:
BDBM50175665
Synonyms:
(R)-(4-(4-(2,4-dichlorobenzylamino)pyrimidin-2-yl)piperazin-1-yl)(piperidin-2-yl)methanone | CHEMBL372399
Type:
Small organic molecule
Emp. Form.:
C21H26Cl2N6O
Mol. Mass.:
449.377
SMILES:
Clc1ccc(CNc2ccnc(n2)N2CCN(CC2)C(=O)[C@H]2CCCCN2)c(Cl)c1
Structure:
Search PDB for entries with ligand similarity: