BDBM152987 US8993614, 52

SMILES: [H][C@@]1(COC(C)(C)O1)[C@@]1([H])C[C@]2([H])OC(C)(C)O[C@]2([H])[C@H]1OC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1

InChI Key: InChIKey=ZBJSFVIISNQZHP-XSPMNBIQSA-N

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 = 152987   

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
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM152987 (US8993614, 52) Show SMILES [H][C@@]1(COC(C)(C)O1)[C@@]1([H])C[C@]2([H])OC(C)(C)O[C@]2([H])[C@H]1OC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r| Show InChI InChI=1S/C47H53Cl2F2N3O11/c1-23(61-43(57)62-39-27(34-21-59-45(5,6)64-34)19-33-40(39)65-46(7,8)63-33)60-42(56)24-13-16-31(32(17-24)58-9)53-41(55)38-36(26-11-10-12-29(49)37(26)51)47(22-52,35(54-38)20-44(2,3)4)28-15-14-25(48)18-30(28)50/h10-18,23,27,33-36,38-40,54H,19-21H2,1-9H3,(H,53,55)/t23?,27-,33+,34-,35+,36+,38-,39+,40+,47+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	26.7	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche AG US Patent					Assay Description The ability of the compounds to inhibit the interaction between p53 and MDM2 proteins was measured by an HTRF (homogeneous time-resolved fluorescence...				US Patent US8993614 (2015) BindingDB Entry DOI: 10.7270/Q27W69XV
					More data for this Ligand-Target Pair