BDBM33000 3H-Benzoimidazole-5-carboxylic acid [1-(2-nitro-phenyl)-meth-(E)-ylidene]-hydrazide::MLS000768018::N-[(2-nitrobenzylidene)amino]-3H-benzimidazole-5-carboxamide::N-[(2-nitrophenyl)methylideneamino]-3H-benzimidazole-5-carboxamide::SMR000431332::cid_947659

SMILES: [O-][N+](=O)c1ccccc1C=NNC(=O)c1ccc2nc[nH]c2c1

InChI Key: InChIKey=FNCMTJQTPCSTJV-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 33000   

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
Coagulation factor XI (Homo sapiens (Human))	BDBM33000 (3H-Benzoimidazole-5-carboxylic acid [1-(2-nitro-ph...) Show SMILES [O-][N+](=O)c1ccccc1C=NNC(=O)c1ccc2nc[nH]c2c1 |w:10.11| Show InChI InChI=1S/C15H11N5O3/c21-15(10-5-6-12-13(7-10)17-9-16-12)19-18-8-11-3-1-2-4-14(11)20(22)23/h1-9H,(H,16,17)(H,19,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	7.4	23
PCMD Curated by PubChem BioAssay					Assay Description Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2H993J6
					More data for this Ligand-Target Pair
Kallikrein 5 (Homo sapiens (Human))	BDBM33000 (3H-Benzoimidazole-5-carboxylic acid [1-(2-nitro-ph...) Show SMILES [O-][N+](=O)c1ccccc1C=NNC(=O)c1ccc2nc[nH]c2c1 |w:10.11| Show InChI InChI=1S/C15H11N5O3/c21-15(10-5-6-12-13(7-10)17-9-16-12)19-18-8-11-3-1-2-4-14(11)20(22)23/h1-9H,(H,16,17)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	889	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2GH9GC8
					More data for this Ligand-Target Pair
Factor XIIa (Homo sapiens (Human))	BDBM33000 (3H-Benzoimidazole-5-carboxylic acid [1-(2-nitro-ph...) Show SMILES [O-][N+](=O)c1ccccc1C=NNC(=O)c1ccc2nc[nH]c2c1 |w:10.11| Show InChI InChI=1S/C15H11N5O3/c21-15(10-5-6-12-13(7-10)17-9-16-12)19-18-8-11-3-1-2-4-14(11)20(22)23/h1-9H,(H,16,17)(H,19,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q21G0JQS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM33000 (3H-Benzoimidazole-5-carboxylic acid [1-(2-nitro-ph...) Show SMILES [O-][N+](=O)c1ccccc1C=NNC(=O)c1ccc2nc[nH]c2c1 |w:10.11| Show InChI InChI=1S/C15H11N5O3/c21-15(10-5-6-12-13(7-10)17-9-16-12)19-18-8-11-3-1-2-4-14(11)20(22)23/h1-9H,(H,16,17)(H,19,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.34E+3	n/a	n/a	n/a	n/a	7.5	23
PCMD Curated by PubChem BioAssay					Assay Description HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K64GDN
					More data for this Ligand-Target Pair