BDBM236325 US9365576, 78

SMILES: COc1nc(N)ncc1-c1cc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CCOCC1

InChI Key: InChIKey=MUUZZGAMDJCACC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 236325   

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
p53-MDM2 (Homo sapiens (Human))	BDBM236325 (US9365576, 78) Show SMILES COc1nc(N)ncc1-c1cc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CCOCC1 Show InChI InChI=1S/C25H28ClN5O3/c1-14(2)30-20(19-13-28-25(27)29-23(19)33-3)12-18-22(30)21(15-4-6-16(26)7-5-15)31(24(18)32)17-8-10-34-11-9-17/h4-7,12-14,17,21H,8-11H2,1-3H3,(H2,27,28,29)	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.5	n/a	n/a	n/a	n/a	n/a	25
Novartis AG US Patent					Assay Description Assay 1: The test is performed in white 384-well plates (Greiner Bio-One, reference 781207) in a total volume of 60 μL by adding 1 μL of compou...				US Patent US9365576 (2016) BindingDB Entry DOI: 10.7270/Q2DN43XR
					More data for this Ligand-Target Pair
p53-MDM2 (Homo sapiens (Human))	BDBM236325 (US9365576, 78) Show SMILES COc1nc(N)ncc1-c1cc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CCOCC1 Show InChI InChI=1S/C25H28ClN5O3/c1-14(2)30-20(19-13-28-25(27)29-23(19)33-3)12-18-22(30)21(15-4-6-16(26)7-5-15)31(24(18)32)17-8-10-34-11-9-17/h4-7,12-14,17,21H,8-11H2,1-3H3,(H2,27,28,29)	PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.08	n/a	n/a	n/a	n/a	n/a	25
Novartis AG US Patent					Assay Description Assay 2: The test is performed in white 384-well plates (Greiner Bio-One, reference 781207) in a total volume of 60 μL by adding 1 μL of compou...				US Patent US9365576 (2016) BindingDB Entry DOI: 10.7270/Q2DN43XR
					More data for this Ligand-Target Pair
p53-MDM4 (Homo sapiens (Human))	BDBM236325 (US9365576, 78) Show SMILES COc1nc(N)ncc1-c1cc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CCOCC1 Show InChI InChI=1S/C25H28ClN5O3/c1-14(2)30-20(19-13-28-25(27)29-23(19)33-3)12-18-22(30)21(15-4-6-16(26)7-5-15)31(24(18)32)17-8-10-34-11-9-17/h4-7,12-14,17,21H,8-11H2,1-3H3,(H2,27,28,29)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	25
Novartis AG US Patent					Assay Description Assay 1: The test is performed in white 384-well plates (Greiner Bio-One, reference 781207) in a total volume of 60 μL by adding 1 μL of compou...				US Patent US9365576 (2016) BindingDB Entry DOI: 10.7270/Q2DN43XR
					More data for this Ligand-Target Pair