BDBM50116442 CHEMBL3604410

SMILES CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O

InChI Key InChIKey=XBHFMBJIYPVLCL-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 = 50116442   

TargetCarbonic anhydrase 12(Human)
University of Chieti-Pescara

Curated by ChEMBL
LigandPNGBDBM50116442(CHEMBL3604410)
Affinity DataKi:  9.60nMAssay Description:Inhibition of human carbonic anhydrase-12 incubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Chieti-Pescara

Curated by ChEMBL
LigandPNGBDBM50116442(CHEMBL3604410)
Affinity DataKi:  32nMAssay Description:Inhibition of human carbonic anhydrase-9 incubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Chieti-Pescara

Curated by ChEMBL
LigandPNGBDBM50116442(CHEMBL3604410)
Affinity DataKi:  788nMAssay Description:Inhibition of human carbonic anhydrase-2 incubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Chieti-Pescara

Curated by ChEMBL
LigandPNGBDBM50116442(CHEMBL3604410)
Affinity DataKi:  1.18E+3nMAssay Description:Inhibition of human carbonic anhydrase-1 incubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2016
Entry Details Article
PubMed