BDBM22947 1-[(2R)-4-{5-[3-(4-chlorophenyl)propoxy]-1-methyl-1H-indol-3-yl}-1-hydroxybutan-2-yl]-1H-imidazole-4-carboxamide::CHEMBL340297::Hybrid compound 1(FR235999) derivative, 8c

SMILES Cn1cc(CC[C@H](CO)n2cnc(c2)C(N)=O)c2cc(OCCCc3ccc(Cl)cc3)ccc12

InChI Key InChIKey=LOLFJCSELDRAPA-OAQYLSRUSA-N

Data  1 KI  1 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 2 hits for monomerid = 22947   

TargetAdenosine deaminase(Homo sapiens (Human))
Fujisawa Pharmaceutical

LigandPNGBDBM22947(1-[(2R)-4-{5-[3-(4-chlorophenyl)propoxy]-1-methyl-...)
Affinity DataKi:  4.90nM ΔG°:  -11.2kcal/molepH: 7.4 T: 2°CAssay Description:The reaction velocity was measured by change in absorbance at 265nm (A265) resulting from the deamination of adenosine. The reaction was started by a...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine deaminase(Homo sapiens (Human))
Fujisawa Pharmaceutical

LigandPNGBDBM22947(1-[(2R)-4-{5-[3-(4-chlorophenyl)propoxy]-1-methyl-...)
Affinity DataIC50:  6.70nMAssay Description:Inhibitory concentration against adenosine deaminaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed