BDBM88707 2-hydroxybenzoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester::2-hydroxybenzoic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester::MLS002165662::SMR001248023::[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 2-oxidanylbenzoate::[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 2-hydroxybenzoate::cid_2689580

SMILES: Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1O

InChI Key: InChIKey=VGNVLRWGOYTDRG-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 88707   

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
Antrax lethal toxin (Bacillus anthracis)	BDBM88707 (2-hydroxybenzoic acid [2-(2-methyl-1H-indol-3-yl)-...) Show SMILES Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1O Show InChI InChI=1S/C18H15NO4/c1-11-17(12-6-2-4-8-14(12)19-11)16(21)10-23-18(22)13-7-3-5-9-15(13)20/h2-9,19-20H,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1 R03 MH093184-01A1 Project Title: High-throughput multiplex microsphere screening for tox...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q26D5RK7
					More data for this Ligand-Target Pair
botulinum neurotoxin type F, BoNT/F (Clostridium botulinum Bf)	BDBM88707 (2-hydroxybenzoic acid [2-(2-methyl-1H-indol-3-yl)-...) Show SMILES Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1O Show InChI InChI=1S/C18H15NO4/c1-11-17(12-6-2-4-8-14(12)19-11)16(21)10-23-18(22)13-7-3-5-9-15(13)20/h2-9,19-20H,10H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1 R03 MH093184-01A1 Project Title: High-throughput multiplex microsphere screening for tox...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2XW4HD2
					More data for this Ligand-Target Pair
botulinum neurotoxin type A (Clostridium botulinum (strain Hall / ATCC 3502 / N...)	BDBM88707 (2-hydroxybenzoic acid [2-(2-methyl-1H-indol-3-yl)-...) Show SMILES Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1O Show InChI InChI=1S/C18H15NO4/c1-11-17(12-6-2-4-8-14(12)19-11)16(21)10-23-18(22)13-7-3-5-9-15(13)20/h2-9,19-20H,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1 R03 MH093184-01A1 Project Title: High-throughput multiplex microsphere screening for tox...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q22N50WB
					More data for this Ligand-Target Pair