BDBM53402 (3R,3aR,7aR)-2-benzyl-3-(1-bromo-2-naphthyl)-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one::(3R,3aR,7aR)-2-benzyl-3-(1-bromonaphthalen-2-yl)-7a-methyl-3,3a,6,7-tetrahydroisoindol-1-one::(3R,3aR,7aR)-3-(1-bromanylnaphthalen-2-yl)-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one::(3R,3aR,7aR)-3-(1-bromo-2-naphthalenyl)-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one::MLS000882836::PiB::SMR000465414::cid_16060474

SMILES: C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br

InChI Key: InChIKey=MKUQHWSYDVIMFL-LLZJGCNPSA-N

Data: 3 IC50  1 EC50

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 4 hits for monomerid = 53402   

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
Peptidyl-prolyl cis-trans isomerase (Saccharomyces cerevisiae (Baker's yeast))	BDBM53402 ((3R,3aR,7aR)-2-benzyl-3-(1-bromo-2-naphthyl)-7a-me...) Show SMILES C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br |c:4| Show InChI InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	7.0	0
Tohoku University					Assay Description Assay was carried out measuring the MCA fluorescence using Suc-Ala-Glu-Pro-Phe-MCA as substrate purchased from Japan Peptide Institute Co.				Chem Biol 10: 15-24 (2003) Article DOI: 10.1016/S1074-5521(02)00310-1 BindingDB Entry DOI: 10.7270/Q24Q7SDN
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM53402 ((3R,3aR,7aR)-2-benzyl-3-(1-bromo-2-naphthyl)-7a-me...) Show SMILES C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br |c:4| Show InChI InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	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/Q2F18X8S
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM53402 ((3R,3aR,7aR)-2-benzyl-3-(1-bromo-2-naphthyl)-7a-me...) Show SMILES C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br |c:4| Show InChI InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.93E+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
streptokinase A precursor (Streptococcus pyogenes M1 GAS)	BDBM53402 ((3R,3aR,7aR)-2-benzyl-3-(1-bromo-2-naphthyl)-7a-me...) Show SMILES C[C@@]12CCC=C[C@H]1[C@@H](N(Cc1ccccc1)C2=O)c1ccc2ccccc2c1Br |c:4| Show InChI InChI=1S/C26H24BrNO/c1-26-16-8-7-13-22(26)24(28(25(26)29)17-18-9-3-2-4-10-18)21-15-14-19-11-5-6-12-20(19)23(21)27/h2-7,9-15,22,24H,8,16-17H2,1H3/t22-,24-,26+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	5.76E+3	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2736PBV
					More data for this Ligand-Target Pair