BDBM50155549 2-Butyl-hexanoic acid (5-sulfamoyl-indan-2-yl)-amide::CHEMBL185041
SMILES: CCCCC(CCCC)C(=O)NC1Cc2ccc(cc2C1)S(N)(=O)=O
InChI Key: InChIKey=PZMNZELZNFVQAV-UHFFFAOYSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM50155549 (2-Butyl-hexanoic acid (5-sulfamoyl-indan-2-yl)-ami...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ Joseph Fourier de Grenoble Curated by ChEMBL | Assay Description Binding affinity towards human cloned carbonic anhydrase I | Bioorg Med Chem Lett 14: 5781-6 (2004) Article DOI: 10.1016/j.bmcl.2004.09.061 BindingDB Entry DOI: 10.7270/Q2WD41CP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 2 (Homo sapiens (Human)) | BDBM50155549 (2-Butyl-hexanoic acid (5-sulfamoyl-indan-2-yl)-ami...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ Joseph Fourier de Grenoble Curated by ChEMBL | Assay Description Binding affinity towards human cloned carbonic anhydrase II | Bioorg Med Chem Lett 14: 5781-6 (2004) Article DOI: 10.1016/j.bmcl.2004.09.061 BindingDB Entry DOI: 10.7270/Q2WD41CP | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (docked) |