BDBM44450 (3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluoromethyl)thiazol-2-yl]amine::MLS000085296::N-[(3,5-dimethyl-1-pyrazolyl)methyl]-4-(trifluoromethyl)-2-thiazolamine::N-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine::N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(trifluoromethyl)-1,3-thiazol-2-amine::SMR000020034::cid_3244409
SMILES: Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
InChI Key: InChIKey=KCEKBUJLKKSISN-UHFFFAOYSA-N
Data: 4 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ephrin type-A receptor 4 (Mus musculus) | BDBM44450 ((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2P55KW4 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Phosphomannomutase 2 (Homo sapiens (Human)) | BDBM44450 ((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Medical Research Institute Curated by ChEMBL | Assay Description Inhibition of human purified PMM2 | J Med Chem 54: 3661-8 (2011) Article DOI: 10.1021/jm101401a BindingDB Entry DOI: 10.7270/Q28C9WKP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mannose-6-phosphate isomerase (Homo sapiens (Human)) | BDBM44450 ((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sanford-Burnham Medical Research Institute Curated by ChEMBL | Assay Description Inhibition of human purified phosphomannose isomerase | J Med Chem 54: 3661-8 (2011) Article DOI: 10.1021/jm101401a BindingDB Entry DOI: 10.7270/Q28C9WKP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ephrin type-A receptor 4 (Mus musculus) | BDBM44450 ((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen... | PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2JD4V5T | |||||||||||
More data for this Ligand-Target Pair |