BDBM585326 5-(4-(3-(2-chloropyrimidin-5- yl)phenyl)piperazin-1- yl)pyrimidine-2,4-diamine::US11530198, Example 100

SMILES Nc1ncc(N2CCN(CC2)c2cccc(c2)-c2cnc(Cl)nc2)c(N)n1

InChI Key InChIKey=ZZVQNBSVOSNTLV-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 585326   

TargetDihydrofolate reductase(Human)
Vyera Pharmaceuticals

US Patent
LigandPNGBDBM585326(US11530198, Example 100 | 5-(4-(3-(2-chloropyrimid...)
Affinity DataIC50: 1.32E+3nMAssay Description:TBDMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/16/2023
Entry Details
Go to US Patent

TargetBifunctional dihydrofolate reductase-thymidylate synthase(Toxoplasma gondii)
Vyera Pharmaceuticals

US Patent
LigandPNGBDBM585326(US11530198, Example 100 | 5-(4-(3-(2-chloropyrimid...)
Affinity DataIC50: 6.76nMAssay Description:TBDMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/16/2023
Entry Details
Go to US Patent

TargetDihydrofolate reductase(Human)
Vyera Pharmaceuticals

US Patent
LigandPNGBDBM585326(US11530198, Example 100 | 5-(4-(3-(2-chloropyrimid...)
Affinity DataIC50: 1.32E+3nMAssay Description:TBDMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/16/2023
Entry Details
Go to US Patent

TargetBifunctional dihydrofolate reductase-thymidylate synthase(Trypanosoma brucei brucei)
Vyera Pharmaceuticals

US Patent
LigandPNGBDBM585326(US11530198, Example 100 | 5-(4-(3-(2-chloropyrimid...)
Affinity DataIC50: 2.51nMAssay Description:TBDMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/16/2023
Entry Details
Go to US Patent