BDBM50255432 CHEMBL516921::N-allyl-4-(3-(4-bromophenyl)benzo[d]isothiazol-6-yloxy)-N-methylbutan-1-amine
SMILES: CN(CCCCOc1ccc2c(nsc2c1)-c1ccc(Br)cc1)CC=C
InChI Key: InChIKey=PDHRIPJKNGUCJP-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cycloartenol synthase (Arabidopsis thaliana) | BDBM50255432 (CHEMBL516921 | N-allyl-4-(3-(4-bromophenyl)benzo[d...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Torino Curated by ChEMBL | Assay Description Inhibition of Arabidopsis thaliana cycloartenol synthase expressed in Saccharomyces cerevisiae SMY8 | Bioorg Med Chem Lett 19: 718-23 (2009) Article DOI: 10.1016/j.bmcl.2008.12.040 BindingDB Entry DOI: 10.7270/Q2SF2W2N | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Lanosterol synthase (Saccharomyces cerevisiae) | BDBM50255432 (CHEMBL516921 | N-allyl-4-(3-(4-bromophenyl)benzo[d...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Torino Curated by ChEMBL | Assay Description Inhibition of yeast OSC expressed in Saccharomyces cerevisiae SMY8 | Bioorg Med Chem Lett 19: 718-23 (2009) Article DOI: 10.1016/j.bmcl.2008.12.040 BindingDB Entry DOI: 10.7270/Q2SF2W2N | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Lanosterol synthase (Homo sapiens (Human)) | BDBM50255432 (CHEMBL516921 | N-allyl-4-(3-(4-bromophenyl)benzo[d...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Torino Curated by ChEMBL | Assay Description Inhibition of human OSC expressed in Saccharomyces cerevisiae SMY8 | Bioorg Med Chem Lett 19: 718-23 (2009) Article DOI: 10.1016/j.bmcl.2008.12.040 BindingDB Entry DOI: 10.7270/Q2SF2W2N | |||||||||||
More data for this Ligand-Target Pair |