BDBM50198892 3-AP::3-aminopyridine-2-carboxaldehyde thiosemicarbazone::Triapine::US10155732, Compound 3-AP

SMILES NC(=S)N\N=C\c1ncccc1N

InChI Key InChIKey=XMYKNCNAZKMVQN-NYYWCZLTSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50198892   

TargetCDGSH iron-sulfur domain-containing protein 1(Homo sapiens (Human))
West Virginia University

Curated by ChEMBL
LigandPNGBDBM50198892(3-AP | 3-aminopyridine-2-carboxaldehyde thiosemica...)
Affinity DataKi:  388nMAssay Description:Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRibonucleoside-diphosphate reductase subunit M2(Homo sapiens (Human))
Case Western Reserve University

Curated by ChEMBL
LigandPNGBDBM50198892(3-AP | 3-aminopyridine-2-carboxaldehyde thiosemica...)
Affinity DataIC50:  185nMAssay Description:Inhibition of human RRM2 expressed in Escherichia coli BL21-codon plus(DE3) using [14C]-ADP as substrate after 3 mins by liquid scintillation countin...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRibonucleoside-diphosphate reductase large subunit/subunit M2(Homo sapiens (Human))
City Of Hope

US Patent
LigandPNGBDBM50198892(3-AP | 3-aminopyridine-2-carboxaldehyde thiosemica...)
Affinity DataIC50:  1.20E+3nMAssay Description:A diverse compound library from NCI Developmental Therapeutics Program (DTP) was subjected to a virtual screening process to identify potential RR in...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetCDGSH iron-sulfur domain-containing protein 1(Homo sapiens (Human))
West Virginia University

Curated by ChEMBL
LigandPNGBDBM50198892(3-AP | 3-aminopyridine-2-carboxaldehyde thiosemica...)
Affinity DataIC50:  9.08E+3nMAssay Description:Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed