BDBM50557370 CHEMBL4777557

SMILES COc1ccc(cc1)-c1cn(Cc2ccc(cc2)C(C)(C)C)nn1

InChI Key InChIKey=XGJMAGUPJCMKQV-UHFFFAOYSA-N

Data  2 IC50  2 Kd

  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 = 50557370   

TargetHeat shock protein HSP 90-beta(Human)
Sun Yat-Sen University

Curated by ChEMBL
LigandPNGBDBM50557370(CHEMBL4777557)
Affinity DataKd:  4.80E+3nMAssay Description:Binding affinity to HSP90-beta (unknown origin) expressed in Escherichia coli BL21 by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-alpha(Human)
Sun Yat-Sen University

Curated by ChEMBL
LigandPNGBDBM50557370(CHEMBL4777557)
Affinity DataKd:  4.80E+3nMAssay Description:Binding affinity to HSP90-alpha (unknown origin) expressed in Escherichia coli BL21 by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-alpha(Human)
Sun Yat-Sen University

Curated by ChEMBL
LigandPNGBDBM50557370(CHEMBL4777557)
Affinity DataIC50: 5.60E+3nMAssay Description:Inhibition of HSP90-alpha (unknown origin) expressed in Escherichia coli BL21 assessed as reduction in ATPase activity in presence of PEP, NADH and A...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-beta(Human)
Sun Yat-Sen University

Curated by ChEMBL
LigandPNGBDBM50557370(CHEMBL4777557)
Affinity DataIC50: 5.60E+3nMAssay Description:Inhibition of HSP90-beta (unknown origin) expressed in Escherichia coli BL21 assessed as reduction in ATPase activity in presence of PEP, NADH and AT...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed