BDBM108084 3-((5-nitrothiophen-2-yl)methylene)indolin-2-one (Compound 25)
SMILES: [O-][N+](=O)c1ccc(\C=C2/C(=O)Nc3ccccc23)s1
InChI Key: InChIKey=AUAHMFNEVSFPBU-YFHOEESVSA-N
Data: 1 IC50
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 |
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Chorismate mutase (MTB CM) (Mycobacterium tuberculosis H37Rv) | BDBM108084 (3-((5-nitrothiophen-2-yl)methylene)indolin-2-one (...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 930 | n/a | n/a | n/a | n/a | n/a | 37 |
Birla Institute of Technology & Science-Pilani, Hyderabad Campus, Shameerpet, R.R. District, Hyderabad, Andhra Pradesh, 500078, India | Assay Description The reaction was initiated by the addition of 150pmoles of enzyme to a mixture of inhibitor (40µM, 20 µM, 10 µM, 5 µM, 1 µM ... | Chem Biol Drug Des 83: 498-506 (2014) Article DOI: 10.1111/cbdd.12265 BindingDB Entry DOI: 10.7270/Q2F76B65 | |||||||||||
More data for this Ligand-Target Pair |