null

SMILES OB(O)c1ccccc1

InChI Key InChIKey=HXITXNWTGFUOAU-UHFFFAOYSA-N

PDB links: 5 PDB IDs match this monomer. 14 PDB IDs contain this monomer as substructures. 14 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

  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 2 hits for monomerid = 26996   

TargetCarbonic anhydrase 14(Homo sapiens (Human))
Università degli Studi di Firenze, Dipartimento Neurofarba, Sezione di Scienze Farmaceutiche e Nutraceutiche, Via U. Schiff 6, 50019 Sesto Fiorentino, Florence, Italy. Electronic address: claudiu.sup

Curated by ChEMBL
LigandPNGBDBM26996(CHEMBL21485 | PhB(OH)2 | Phenyl-boronic acid | Phe...)copy SMILEScopy InChI
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human CA14 by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q24170HKPubMed
TargetCarbonic anhydrase 14(Homo sapiens (Human))
Università degli Studi di Firenze, Dipartimento Neurofarba, Sezione di Scienze Farmaceutiche e Nutraceutiche, Via U. Schiff 6, 50019 Sesto Fiorentino, Florence, Italy. Electronic address: claudiu.sup

Curated by ChEMBL
LigandPNGBDBM26996(CHEMBL21485 | PhB(OH)2 | Phenyl-boronic acid | Phe...)copy SMILEScopy InChI
Affinity DataKi:  9.20E+4nMAssay Description:Inhibition of human recombinant full length CA14More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q29886PNPubMed