Target
T-cell surface glycoprotein CD4
Ligand
BDBM50097416
Substrate
n/a
Meas. Tech.
ChEMBL_101473 (CHEMBL712351)
EC50
>66000±n/a nM
Citation
 Santhosh, KCPaul, GCDe Clercq, EPannecouque, CWitvrouw, MLoftus, TLTurpin, JABuckheit, RWCushman, 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:
BDBM50097416
Synonyms:
CHEMBL383913 | Cosalane analogue
Type:
Small organic molecule
Emp. Form.:
C65H80N2O14
Mol. Mass.:
1113.3357
SMILES:
[#6]-[#8]-c1ccc(cc1-[#6](-[#8])=O)-[#6](=O)-[#7]-c1cc(cc(-[#6](-[#8])=O)c1-[#8]-[#6])-[#6](=[#6]\[#6]-[#6]-[#6@H]-1-[#6]-[#6][C@@]2([#6])[#6](-[#6]-[#6]-[#6]-3-[#6]4-[#6]-[#6]-[#6@H](-[#6](-[#6])-[#6]-[#6]-[#6]-[#6](-[#6])-[#6])[C@@]4([#6])[#6]-[#6]-[#6]2-3)-[#6]-1)\c1cc(-[#7]-[#6](=O)-c2ccc(-[#8]-[#6])c(c2)-[#6](-[#8])=O)c(-[#8]-[#6])c(c1)-[#6](-[#8])=O
Structure:
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