BDBM215316 US9296736, 278

SMILES: C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CN(c2ccccc2[N+]#[C-])S(C)(=O)=O)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1

InChI Key: InChIKey=QOAQLKTWNCTKNW-DLZIYRPJSA-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 = 215316   

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
MDM2 and p53 (Homo sapiens (Human))	BDBM215316 (US9296736, 278) Show SMILES C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CN(c2ccccc2[N+]#[C-])S(C)(=O)=O)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C33H33Cl2N3O5S/c1-33(19-30(39)40)18-26(23-7-6-8-25(35)17-23)31(22-13-15-24(34)16-14-22)38(32(33)41)29(21-11-12-21)20-37(44(3,42)43)28-10-5-4-9-27(28)36-2/h4-10,13-17,21,26,29,31H,11-12,18-20H2,1,3H3,(H,39,40)/t26-,29-,31-,33-/m1/s1	PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.200	n/a	n/a	n/a	n/a	7.4	25
Amgen INC. US Patent					Assay Description The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...				US Patent US9296736 (2016) BindingDB Entry DOI: 10.7270/Q29022M2
					More data for this Ligand-Target Pair