BDBM50074718 6-(3-Methoxy-benzyl)-5,6,7,8-tetrahydro-quinazoline-2,4-diamine::6-(3-methoxybenzyl)-5,6,7,8-tetrahydroquinazoline-2,4-diamine::CHEMBL268355
SMILES: COc1cccc(CC2CCc3nc(N)nc(N)c3C2)c1
InChI Key: InChIKey=CMALOCWWCHGZIN-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Dihydrofolate reductase (Rattus norvegicus (rat)) | BDBM50074718![]() (6-(3-Methoxy-benzyl)-5,6,7,8-tetrahydro-quinazolin...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School Curated by ChEMBL | Assay Description The ability of the compound to inhibit rat liver Dihydrofolate reductase was tested | J Med Chem 42: 1007-17 (1999) Article DOI: 10.1021/jm980572i BindingDB Entry DOI: 10.7270/Q2513XCR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dihydrofolate reductase (Pneumocystis carinii) | BDBM50074718![]() (6-(3-Methoxy-benzyl)-5,6,7,8-tetrahydro-quinazolin...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School Curated by ChEMBL | Assay Description The ability of the compound to inhibit P. carinii Dihydrofolate reductase was tested | J Med Chem 42: 1007-17 (1999) Article DOI: 10.1021/jm980572i BindingDB Entry DOI: 10.7270/Q2513XCR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional dihydrofolate reductase-thymidylate synthase (Toxoplasma gondii) | BDBM50074718![]() (6-(3-Methoxy-benzyl)-5,6,7,8-tetrahydro-quinazolin...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School Curated by ChEMBL | Assay Description The ability of the compound to inhibit T. gondii Dihydrofolate reductase was tested | J Med Chem 42: 1007-17 (1999) Article DOI: 10.1021/jm980572i BindingDB Entry DOI: 10.7270/Q2513XCR | |||||||||||
More data for this Ligand-Target Pair |