BDBM227634 MTH1 inhibitor, 121
SMILES: COc1ccc(CCNc2nc(N)nc3[nH]cnc23)cc1OC
InChI Key: InChIKey=HJTKPCKUPKRWOL-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MutT homolog 1 protein (MTH1) (Homo sapiens (Human)) | BDBM227634 (MTH1 inhibitor, 121) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 420 | n/a | n/a | n/a | n/a | 7.5 | n/a |
RIKEN Center for Life Science Technologies | Assay Description Enzymatic reaction was initiated by adding either 8-oxo-dGTP (13.2 μm; TriLink BioTechnologies) or 2-OH-dATP (8.3 μm; Jena Bioscience) to r... | Chem Biol Drug Des 89: 862-869 (2017) Article DOI: 10.1111/cbdd.12909 BindingDB Entry DOI: 10.7270/Q24748RZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MutT homolog 1 protein (MTH1) (Homo sapiens (Human)) | BDBM227634 (MTH1 inhibitor, 121) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 210 | n/a | n/a | n/a | n/a | 7.5 | n/a |
RIKEN Center for Life Science Technologies | Assay Description Enzymatic reaction was initiated by adding either 8-oxo-dGTP (13.2 μm; TriLink BioTechnologies) or 2-OH-dATP (8.3 μm; Jena Bioscience) to r... | Chem Biol Drug Des 89: 862-869 (2017) Article DOI: 10.1111/cbdd.12909 BindingDB Entry DOI: 10.7270/Q24748RZ | |||||||||||
More data for this Ligand-Target Pair |