null

SMILES: CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O

InChI Key: InChIKey=FORQBKKGQBHPBA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 83968   

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
Caspase-9 (Homo sapiens (Human))	BDBM83968 (1-[3-(brosylamino)-1,4-diketo-2-naphthyl]nipecotic...) Show SMILES CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O |c:12| Show InChI InChI=1S/C24H23BrN2O6S/c1-2-33-24(30)15-6-5-13-27(14-15)21-20(22(28)18-7-3-4-8-19(18)23(21)29)26-34(31,32)17-11-9-16(25)10-12-17/h3-4,7-12,15,26H,2,5-6,13-14H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q25M647F
					More data for this Ligand-Target Pair
Apoptotic protease-activating factor 1 (Homo sapiens (Human))	BDBM83968 (1-[3-(brosylamino)-1,4-diketo-2-naphthyl]nipecotic...) Show SMILES CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O |c:12| Show InChI InChI=1S/C24H23BrN2O6S/c1-2-33-24(30)15-6-5-13-27(14-15)21-20(22(28)18-7-3-4-8-19(18)23(21)29)26-34(31,32)17-11-9-16(25)10-12-17/h3-4,7-12,15,26H,2,5-6,13-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.95E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2JS9NZB
					More data for this Ligand-Target Pair
Apoptotic protease-activating factor 1 (Homo sapiens (Human))	BDBM83968 (1-[3-(brosylamino)-1,4-diketo-2-naphthyl]nipecotic...) Show SMILES CCOC(=O)C1CCCN(C1)C1=C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O |c:12| Show InChI InChI=1S/C24H23BrN2O6S/c1-2-33-24(30)15-6-5-13-27(14-15)21-20(22(28)18-7-3-4-8-19(18)23(21)29)26-34(31,32)17-11-9-16(25)10-12-17/h3-4,7-12,15,26H,2,5-6,13-14H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2SB447H
					More data for this Ligand-Target Pair