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BDBM50288894 1-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]-acetyl}-pyrrolidine-2-carboxylic acid::CHEMBL2371075

SMILES: NS(=O)(=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(O)=O

InChI Key: InChIKey=PDKJQGAUBCHXKG-ZDUSSCGKSA-N

Data: 1 Kd

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50288894   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50288894
PNG
(1-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]-ac...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(O)=O |r|
Show InChI InChI=1S/C18H23N5O8S/c19-32(30,31)12-5-3-11(4-6-12)17(27)22-9-15(25)20-8-14(24)21-10-16(26)23-7-1-2-13(23)18(28)29/h3-6,13H,1-2,7-10H2,(H,20,25)(H,21,24)(H,22,27)(H,28,29)(H2,19,30,31)/t13-/m0/s1
PDB
MMDB

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Similars

Article
n/an/an/a 330n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Dissociation constant against human carbonic anhydrase II at 37 degree centigrade


Bioorg Med Chem Lett 6: 559-564 (1996)


Article DOI: 10.1016/0960-894X(96)00069-8
BindingDB Entry DOI: 10.7270/Q2V124SF
More data for this
Ligand-Target Pair