BDBM50165141 CHEMBL436762::disodium 2-amino-9-[(2R,4S,5R)-5-{[({[1-carboxylato-2-(1H-indol-3-yl)ethyl]amino}phosphinato)oxy]methyl}-3,4-bis(propan-2-yloxy)oxolan-2-yl]-6-hydroxy-9H-purin-7-ium

SMILES: CC(C)O[C@H]1[C@@H](COP([O-])(=O)NC(Cc2c[nH]c3ccccc23)C([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

InChI Key: InChIKey=LCPCGPAGEYHJFP-LPFOBZOHSA-M

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50165141   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Eukaryotic translation initiation factor 4E (eIF4E) (Homo sapiens (Human))	BDBM50165141 (CHEMBL436762 | disodium 2-amino-9-[(2R,4S,5R)-5-{[...) Show SMILES CC(C)O[C@H]1[C@@H](COP([O-])(=O)NC(Cc2c[nH]c3ccccc23)C([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O Show InChI InChI=1S/C27H36N7O9P/c1-13(2)41-21-19(43-25(22(21)42-14(3)4)34-12-30-20-23(34)31-27(28)32-24(20)35)11-40-44(38,39)33-18(26(36)37)9-15-10-29-17-8-6-5-7-16(15)17/h5-8,10,12-14,18-19,21-22,25,29H,9,11H2,1-4H3,(H,36,37)(H2,33,38,39)(H3,28,31,32,35)/p-1/t18?,19-,21+,22?,25-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Inhibitory concentration against 7-methyl-GTP binding to eukaryotic translation initiation factor 4E				Bioorg Med Chem Lett 15: 2177-80 (2005) Article DOI: 10.1016/j.bmcl.2005.01.080 BindingDB Entry DOI: 10.7270/Q27D2VWP
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