BDBM55153 4-(3,4-Dihydroxy-phenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one::4-(3,4-dihydroxyphenyl)-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one::4-[3,4-bis(oxidanyl)phenyl]-6-methyl-5-nitro-3,4-dihydro-1H-pyrimidin-2-one::MLS001204622::SMR000504835::cid_2831285
SMILES: CC1=NC(=O)NC(C1[N+]([O-])=O)c1ccc(O)c(O)c1
InChI Key: InChIKey=HHPHCUFNOYEUSG-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Procathepsin L (Homo sapiens (Human)) | BDBM55153 (4-(3,4-Dihydroxy-phenyl)-6-methyl-5-nitro-3,4-dihy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | PCBioAssay | n/a | n/a | >5.96E+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 Affiliation: The Scripps Research Institute, TSRI Assay Provide... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q20K2704 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
M18 aspartyl aminopeptidase (Plasmodium falciparum 3D7) | BDBM55153 (4-(3,4-Dihydroxy-phenyl)-6-methyl-5-nitro-3,4-dihy...) | PDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | PCBioAssay | n/a | n/a | 864 | 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 Affiliation: The Scripps Research Institute, TSRI Assay Provide... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q24B2ZQ2 | |||||||||||
More data for this Ligand-Target Pair |