BDBM64777 1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridine-4-carbonitrile::1,8-diamino-3-[butyl(ethyl)amino]-6-ethoxy-2,7-naphthyridine-4-carbonitrile::MLS000564759::SMR000151991::cid_5216640
SMILES: CCCCN(CC)c1nc(N)c2c(N)nc(OCC)cc2c1C#N
InChI Key: InChIKey=PYLKIUBYVAMNEF-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Serine/threonine-protein phosphatase PP1-alpha catalytic subunit (Homo sapiens (Human)) | BDBM64777 (1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 6.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q27M06CD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Heat shock factor protein 1 (Mus musculus) | BDBM64777 (1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7...) | PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >2.60E+5 | 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 | |||||||||||||
Serine/threonine-protein phosphatase (Homo sapiens (Human)) | BDBM64777 (1,8-bis(azanyl)-3-[butyl(ethyl)amino]-6-ethoxy-2,7...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q23T9FN4 | |||||||||||
More data for this Ligand-Target Pair |