BDBM11985 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic acid::Salicylic acid derivative, compound 1::chemical diversity library compound 10
SMILES: Cc1ccc(C)n1-c1ccc(C(O)=O)c(O)c1
InChI Key: InChIKey=WAYCNXGAKFXIKA-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Anthrax Lethal Factor (LF) (Bacillus anthracis) | BDBM11985 (4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic a...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | 1.50E+3 | -7.99 | 3.80E+3 | n/a | n/a | n/a | n/a | 7.2 | 27 |
Montana State University | Assay Description For selected lead compounds from fluorescence-based high-throughput screening, Km and Vmax were calculated using the double-reciprocal Lineweaver-Bur... | J Med Chem 49: 5232-44 (2006) Article DOI: 10.1021/jm0605132 BindingDB Entry DOI: 10.7270/Q20C4T19 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human)) | BDBM11985 (4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic a...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | 1.28E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Medical Research Curated by ChEMBL | Assay Description Inhibition of recombinant vaccina H1-related phosphatase expressed in Escherichia coli by Michaelis-Menton kinetic studies | J Med Chem 52: 6716-23 (2009) Article DOI: 10.1021/jm901016k BindingDB Entry DOI: 10.7270/Q2VX0GK3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DnaC helicase (Staphylococcus aureus) | BDBM11985 (4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic a...) | KEGG UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Microbiotix, Inc Curated by ChEMBL | Assay Description Inhibition of Staphylococcus aureus Smith DNA helicase DnaC assessed as strand unwinding after 30 mins by FRET assay | Bioorg Med Chem 17: 4466-76 (2009) Article DOI: 10.1016/j.bmc.2009.05.014 BindingDB Entry DOI: 10.7270/Q22F7NGH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
EPHA4 (Homo sapiens (Human)) | BDBM11985 (4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic a...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | 7.5 | n/a |
Sanford-Burnham Medical Research Institute | Assay Description Protein A-coasted wells (from Pierce Biotechnology) were used to immobilize Eph receptor Fc fusion proteins (from R&D systems)incubated at 1 ug/ml in... | Chem Biol Drug Des 78: 667-78 (2011) Article DOI: 10.1111/j.1747-0285.2011.01199.x BindingDB Entry DOI: 10.7270/Q2FN14QN | |||||||||||
More data for this Ligand-Target Pair |