BDBM50089594 2-{4-[(2-Amino-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-(3-fluoro-4-nitro-benzyl)-amino]-benzoylamino}-pentanedioic acid::CHEMBL287700
SMILES: Nc1nc2ccc(CN(Cc3ccc(c(F)c3)[N+]([O-])=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)cc2c(=O)[nH]1
InChI Key: InChIKey=FSLDCWZHBOQNQT-UHFFFAOYSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Glycinamide ribonucleotide formyltransferase (GARFTase) (Homo sapiens (Human)) | BDBM50089594 (2-{4-[(2-Amino-4-oxo-3,4-dihydro-quinazolin-6-ylme...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 4.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Curated by ChEMBL | Assay Description In vitro inhibitory activity against Glycinamide ribonucleotide transformylase (GAR Tfase) | Bioorg Med Chem Lett 10: 1471-5 (2000) BindingDB Entry DOI: 10.7270/Q2GM86HD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
AICAR transformylase (Homo sapiens (Human)) | BDBM50089594 (2-{4-[(2-Amino-4-oxo-3,4-dihydro-quinazolin-6-ylme...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 5.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Curated by ChEMBL | Assay Description In vitro inhibitory activity against Aminoimidazole carboxamide ribonucleotide transformylase | Bioorg Med Chem Lett 10: 1471-5 (2000) BindingDB Entry DOI: 10.7270/Q2GM86HD | |||||||||||
More data for this Ligand-Target Pair |