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Target
T-cell surface glycoprotein CD4
Ligand
BDBM50093809
Substrate
n/a
Meas. Tech.
ChEMBL_101473 (CHEMBL712351)
EC50
73000±n/a nM
Citation
 Santhosh, KC; Paul, GC; De Clercq, E; Pannecouque, C; Witvrouw, M; Loftus, TL; Turpin, JA; Buckheit, RW; Cushman, M Correlation of anti-HIV activity with anion spacing in a series of cosalane analogues with extended polycarboxylate pharmacophores. J Med Chem 44:703-14 (2001) [PubMed]  Article 
Target
Name:
T-cell surface glycoprotein CD4
Synonyms:
CD4 | CD4_HUMAN | CD_antigen=CD4 | T-cell surface antigen CD4 | T-cell surface antigen T4/Leu-3 | T-cell surface glycoprotein CD4
Type:
PROTEIN
Mol. Mass.:
51136.66
Organism:
Homo sapiens (Human)
Description:
ChEMBL_440402
Residue:
458
Sequence:
MNRGVPFRHLLLVLQLALLPAATQGKKVVLGKKGDTVELTCTASQKKSIQFHWKNSNQIKILGNQGSFLTKGPSKLNDRADSRRSLWDQGNFPLIIKNLKIEDSDTYICEVEDQKEEVQLLVFGLTANSDTHLLQGQSLTLTLESPPGSSPSVQCRSPRGKNIQGGKTLSVSQLELQDSGTWTCTVLQNQKKVEFKIDIVVLAFQKASSIVYKKEGEQVEFSFPLAFTVEKLTGSGELWWQAERASSSKSWITFDLKNKEVSVKRVTQDPKLQMGKKLPLHLTLPQALPQYAGSGNLTLALEAKTGKLHQEVNLVVMRATQLQKNLTCEVWGPTSPKLMLSLKLENKEAKVSKREKAVWVLNPEAGMWQCLLSDSGQVLLESNIKVLPTWSTPVQPMALIVLGGVAGLLLFIGLGIFFCVRCRHRRRQAERMSQIKRLLSEKKTCQCPHRFQKTCSPI
  
Inhibitor
Name:
BDBM50093809
Synonyms:
(S)-2-(3-Chloro-5-{1-[3-chloro-5-((S)-1,3-dicarboxy-propylcarbamoyl)-4-hydroxy-phenyl]-4-[(3S,10S,13R,17R)-17-(1,5-dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl]-butyl}-2-hydroxy-benzoylamino)-pentanedioic acid | 2-(3-Chloro-5-{1-[3-chloro-5-(1,3-dicarboxy-propylcarbamoyl)-4-hydroxy-phenyl]-4-[17-(1,5-dimethyl-hexyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl]-butyl}-2-hydroxy-benzoylamino)-pentanedioic acid | CHEMBL409708
Type:
Small organic molecule
Emp. Form.:
C55H76Cl2N2O12
Mol. Mass.:
1028.104
SMILES:
CC(C)CCCC(C)[C@H]1CCC2C3CCC4C[C@@H](CCCC(c5cc(Cl)c(O)c(c5)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c5cc(Cl)c(O)c(c5)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CC[C@]4(C)C3CC[C@]12C
Structure:
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