Reaction Details Report a problem with these data
Target
C-X-C chemokine receptor type 4
Ligand
BDBM50042947
Substrate
n/a
Meas. Tech.
ChEMBL_879520 (CHEMBL2208929)
Ki
53±n/a nM
Citation
 Gasparik, V; Daubeuf, F; Hachet-Haas, M; Rohmer, F; Gizzi, P; Haiech, J; Galzi, JL; Hibert, M; Bonnet, D; Frossard, N Prodrugs of a CXC Chemokine-12 (CXCL12) Neutraligand Prevent Inflammatory Reactions in an Asthma Model in Vivo. ACS Med Chem Lett 3:10-14 (2012) [PubMed]  Article 
Target
Name:
C-X-C chemokine receptor type 4
Synonyms:
C-X-C chemokine receptor type 4 | C-X-C chemokine receptor type 4 (CXCR4) | CD_antigen=CD184 | CXC-R4 | CXCR-4 | CXCR4 | CXCR4_HUMAN | FB22 | Fusin | HM89 | LCR1 | LESTR | Leukocyte-derived seven transmembrane domain receptor | NPYRL | SDF-1 receptor | Stromal cell-derived factor 1 receptor
Type:
Enzyme
Mol. Mass.:
39754.61
Organism:
Homo sapiens (Human)
Description:
P61073
Residue:
352
Sequence:
MEGISIYTSDNYTEEMGSGDYDSMKEPCFREENANFNKIFLPTIYSIIFLTGIVGNGLVILVMGYQKKLRSMTDKYRLHLSVADLLFVITLPFWAVDAVANWYFGNFLCKAVHVIYTVNLYSSVLILAFISLDRYLAIVHATNSQRPRKLLAEKVVYVGVWIPALLLTIPDFIFANVSEADDRYICDRFYPNDLWVVVFQFQHIMVGLILPGIVILSCYCIIISKLSHSKGHQKRKALKTTVILILAFFACWLPYYIGISIDSFILLEIIKQGCEFENTVHKWISITEALAFFHCCLNPILYAFLGAKFKTSAQHALTSVSRGSSLKILSKGKRGGHSSVSTESESSSFHSS
  
Inhibitor
Name:
BDBM50042947
Synonyms:
1-(4-Chloro-phenyl)-3-(4-hydroxy-3-methoxy-phenyl)-propenone | 1-(4-chlorophenyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-one | 4'-chloro-3-methoxy-4-hydroxychalcone | CHEMBL126657 | Chalcone 4
Type:
Small organic molecule
Emp. Form.:
C16H13ClO3
Mol. Mass.:
288.726
SMILES:
COc1cc(\C=C\C(=O)c2ccc(Cl)cc2)ccc1O
Structure:
Search PDB for entries with ligand similarity: