BDBM50461744 CHEMBL4227124

SMILES CCn1c2c(c(c1Sc3cccc(c3)OC)C)c(nc(n2)N)N

InChI Key InChIKey=ULDSMDKWSKBCEI-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50461744   

TargetDihydrofolate reductase(Human)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50461744(CHEMBL4227124)
Affinity DataIC50: 511nMAssay Description:Inhibition of human recombinant DHFR expressed in Escherichia coli Rosetta Gami B (DE3) competent cells using DHFA as substrate and NADPHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetDihydrofolate reductase(Human pneumocystis pneumonia agent)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50461744(CHEMBL4227124)
Affinity DataIC50: 35nMAssay Description:Inhibition of Pneumocystis jirovecii recombinant DHFR expressed in Escherichia coli Rosetta Gami B (DE3) competent cells using DHFA as substrate and ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/17/2020
Entry Details Article
PubMed