BDBM32261 MLS000081169::N,N-diethyl-4-(3-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)aniline::N,N-diethyl-4-[3-(3-pyridinyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline::SMR000043558::cid_662880::diethyl-[4-[3-(3-pyridyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl]amine
SMILES: CCN(CC)c1ccc(cc1)-c1nn2c(nnc2s1)-c1cccnc1
InChI Key: InChIKey=OSWNMRLFEDXYOC-UHFFFAOYSA-N
Data: 2 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BCL-W (Homo sapiens (Human)) | BDBM32261 (MLS000081169 | N,N-diethyl-4-(3-pyridin-3-yl-[1,2,...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents | PCBioAssay | n/a | n/a | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH 1X01 MH079850-01 HTS to identify small molecule regulators of Bcl-2 family protein int... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2BR8QM3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Isoform Bcl-X(L) (Homo sapiens (Human)) | BDBM32261 (MLS000081169 | N,N-diethyl-4-(3-pyridin-3-yl-[1,2,...) | PDB MMDB B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Patents | PCBioAssay | n/a | n/a | n/a | n/a | 7.92E+3 | n/a | n/a | 7.4 | 4 |
NMMLSC Curated by PubChem BioAssay | Assay Description The HTS assay was conducted in 384-well microplates in a total assay volume per well of 10.1 microliters (5 microliters of bead mixture, 0.1 microlit... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2K935WV | |||||||||||
More data for this Ligand-Target Pair |