BDBM50615941 CHEMBL5290825

SMILES CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)\C=N\OCc1ccc(cc1)S(N)(=O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O

InChI Key InChIKey=ATFCNLVUGGJYEX-UHFFFAOYSA-N

Data  4 KI

  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 = 50615941   

TargetCarbonic anhydrase 2(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50615941(CHEMBL5290825)
Affinity DataKi:  8.60nMAssay Description:Inhibition of human carbonic anhydrase 2 assessed as Ki by stopped-flow carbon dioxide hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed
TargetCarbonic anhydrase 1(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50615941(CHEMBL5290825)
Affinity DataKi:  76nMAssay Description:Inhibition of human carbonic anhydrase 1 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed
TargetCarbonic anhydrase 9(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50615941(CHEMBL5290825)
Affinity DataKi:  936nMAssay Description:Inhibition of human carbonic anhydrase 9 assessed as Ki by stopped-flow carbon dioxide hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed
TargetCarbonic anhydrase 12(Human)
Czech Academy of Sciences

Curated by ChEMBL
LigandPNGBDBM50615941(CHEMBL5290825)
Affinity DataKi:  2.57E+4nMAssay Description:Inhibition of human carbonic anhydrase 12 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed