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(9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,5(10)-TRIENE-3,17-DIYL DISULFAMATE

P00918 — Carbonic anhydrase 2

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Attributes

UniProt ID
P00918
Protein Name
Carbonic anhydrase 2
Ligand Name
(9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,5(10)-TRIENE-3,17-DIYL DISULFAMATE
DrugBank ID
DB08416
PDB Ligand Accession
PO1
ChEMBL ID
CHEMBL218382
PubChem ID
9804302
InChIKey
AQSNIXKAKUZPSI-SSTWWWIQSA-N
SMILES
CC12CCC3c4cc(c(cc4CCC3C1CCC2OS(=O)(=O)N)OS(=O)(=O)N)OC
Drug Action
inhibitor
Affinity Metrics
ki:270 nM
ic50:379 nM
kd:3750 nM