BDBM50266885 CHEMBL4077617

SMILES: Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)OCCN1CCOCC1

InChI Key: InChIKey=NARYQSBNVNMWTO-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50266885   

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-MDMX (Homo sapiens (Human))	BDBM50266885 (CHEMBL4077617) Show SMILES Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)OCCN1CCOCC1 |(30.21,-12.02,;28.67,-12.02,;27.9,-10.69,;26.36,-10.69,;25.59,-12.02,;26.36,-13.35,;27.9,-13.35,;24.05,-12.02,;23.14,-10.78,;21.68,-11.25,;21.68,-12.79,;20.43,-13.69,;19.02,-13.07,;17.78,-13.98,;16.37,-13.35,;16.21,-11.82,;14.8,-11.19,;17.45,-10.91,;18.86,-11.54,;23.14,-13.27,;23.61,-14.73,;22.71,-15.98,;23.61,-17.23,;25.08,-16.75,;26.41,-17.52,;27.75,-16.75,;29.08,-17.52,;27.75,-15.21,;26.41,-14.44,;25.08,-15.21,;21.17,-15.98,;20.4,-14.65,;20.4,-17.31,;18.86,-17.31,;18.09,-18.65,;16.55,-18.65,;15.78,-19.98,;14.24,-19.98,;13.47,-18.65,;14.24,-17.31,;15.78,-17.31,)| Show InChI InChI=1S/C31H27Cl2FN4O3/c32-22-5-1-20(2-6-22)18-38-19-35-28(21-3-8-24(34)9-4-21)30(38)27-25-10-7-23(33)17-26(25)36-29(27)31(39)41-16-13-37-11-14-40-15-12-37/h1-10,17,19,36H,11-16,18H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Binding affinity to human N-terminal MDM2 (1 to 118 residues) expressed in Escherichia coli BL21 (DE3) after 15 mins in presence of 5-FAM-LTFEHYWAQLT...				J Med Chem 60: 4234-4244 (2017) Article DOI: 10.1021/acs.jmedchem.7b00104 BindingDB Entry DOI: 10.7270/Q2BK1FT3
					More data for this Ligand-Target Pair
p53-Binding Protein HDMX (Homo sapiens (Human))	BDBM50266885 (CHEMBL4077617) Show SMILES Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)OCCN1CCOCC1 |(30.21,-12.02,;28.67,-12.02,;27.9,-10.69,;26.36,-10.69,;25.59,-12.02,;26.36,-13.35,;27.9,-13.35,;24.05,-12.02,;23.14,-10.78,;21.68,-11.25,;21.68,-12.79,;20.43,-13.69,;19.02,-13.07,;17.78,-13.98,;16.37,-13.35,;16.21,-11.82,;14.8,-11.19,;17.45,-10.91,;18.86,-11.54,;23.14,-13.27,;23.61,-14.73,;22.71,-15.98,;23.61,-17.23,;25.08,-16.75,;26.41,-17.52,;27.75,-16.75,;29.08,-17.52,;27.75,-15.21,;26.41,-14.44,;25.08,-15.21,;21.17,-15.98,;20.4,-14.65,;20.4,-17.31,;18.86,-17.31,;18.09,-18.65,;16.55,-18.65,;15.78,-19.98,;14.24,-19.98,;13.47,-18.65,;14.24,-17.31,;15.78,-17.31,)| Show InChI InChI=1S/C31H27Cl2FN4O3/c32-22-5-1-20(2-6-22)18-38-19-35-28(21-3-8-24(34)9-4-21)30(38)27-25-10-7-23(33)17-26(25)36-29(27)31(39)41-16-13-37-11-14-40-15-12-37/h1-10,17,19,36H,11-16,18H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	4.02E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Curated by ChEMBL					Assay Description Binding affinity to human N-terminal MDMx (1 to 134 residues) expressed in Escherichia coli BL21 (DE3) after 15 mins in presence of 5-FAM-LTFEHYWAQLT...				J Med Chem 60: 4234-4244 (2017) Article DOI: 10.1021/acs.jmedchem.7b00104 BindingDB Entry DOI: 10.7270/Q2BK1FT3
					More data for this Ligand-Target Pair