BDBM72759 2-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1H-indole::2-methyl-3-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1H-indole::2-methyl-3-[[4-(2-pyridyl)piperazino]methyl]-1H-indole::2-methyl-3-{[4-(2-pyridinyl)piperazino]methyl}-1H-indole::MLS000860449::SMR000458533::cid_2813100
SMILES: Cc1[nH]c2ccccc2c1CN1CCN(CC1)c1ccccn1
InChI Key: InChIKey=ZAXKSLQZANTESC-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acidic mammalian chitinase (AMCase) (Homo sapiens (Human)) | BDBM72759![]() (2-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar | Purchase PC cid PC sid PDB UniChem | PDB Article PubMed | n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc Curated by ChEMBL | Assay Description Inhibition of acidic mammalian chitinase after 60 mins | J Med Chem 53: 6122-8 (2010) Article DOI: 10.1021/jm100533p BindingDB Entry DOI: 10.7270/Q22N538H | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
Hsf1 protein (Mus musculus) | BDBM72759![]() (2-methyl-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar | Purchase PC cid PC sid PDB UniChem | PCBioAssay | n/a | n/a | n/a | n/a | 8.40E+4 | n/a | n/a | n/a | n/a |
Broad Institute Curated by PubChem BioAssay | Assay Description Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2P55KXK | |||||||||||
More data for this Ligand-Target Pair |