BDBM50531165 CHEMBL4519613

SMILES Nc1ncnc2n([C@@H]3O[C@H](COC(=O)c4ccc(cc4)S(F)(=O)=O)[C@@H](O)[C@H]3O)c(NCc3ccc4ncccc4c3)nc12

InChI Key InChIKey=BHBBUIVVUZKDTQ-UHFFFAOYSA-N

Data  8 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50531165   

TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi: <200nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 1 hr nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi: <200nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 1 hr nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  220nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 0.33 hrs nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  220nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 0.33 hrs nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  3.30E+3nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 0.083 hrs nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  3.30E+3nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) after 0.083 hrs nucleotide-derived FP probe displacement based by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  4.70E+3nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) assessed as initial inhibition constant nucleotide-derived FP probe displacement based by fluoresce...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetHeat shock-related 70 kDa protein 2(Human)
The Institute of Cancer Research

Curated by ChEMBL
LigandPNGBDBM50531165(CHEMBL4519613)
Affinity DataKi:  4.70E+3nMAssay Description:Covalent inhibition of HSP72-NBD (unknown origin) assessed as initial inhibition constant nucleotide-derived FP probe displacement based by fluoresce...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed