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BDBM193737 1-(3-(2-(2,4-Dioxopentan-3-ylidene)hydrazinyl)phenyl)-5-phenyl-N3,N4-bis(5-sulfamoyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-3,4-dicarboxamide (5)

SMILES: [#6]-[#6](=O)-[#6](=[#7]/[#7]-c1cccc(c1)-n1nc(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c1-c1ccccc1)\[#6](-[#6])=O

InChI Key: InChIKey=PCILGPUQPGAMSC-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 193737   
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))
BDBM193737
PNG
(1-(3-(2-(2,4-Dioxopentan-3-ylidene)hydrazinyl)phen...)
Show SMILES [#6]-[#6](=O)-[#6](=[#7]/[#7]-c1cccc(c1)-n1nc(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c1-c1ccccc1)\[#6](-[#6])=O
Show InChI InChI=1S/C26H22N12O8S4/c1-12(39)18(13(2)40)32-31-15-9-6-10-16(11-15)38-20(14-7-4-3-5-8-14)17(21(41)29-23-33-35-25(47-23)49(27,43)44)19(37-38)22(42)30-24-34-36-26(48-24)50(28,45)46/h3-11,31H,1-2H3,(H2,27,43,44)(H2,28,45,46)(H,29,33,41)(H,30,34,42)
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Similars

Article
PubMed
494n/an/an/an/an/an/an/an/a



Dumlupinar University



Assay Description
CA activity was measured according to the method described by Verpoorte et al. in inhibition studies, spectrophotometrically [Biochem., 242:4221-4229...


Bioorg Chem 68: 64-71 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.006
BindingDB Entry DOI: 10.7270/Q2N29VQC
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM193737
PNG
(1-(3-(2-(2,4-Dioxopentan-3-ylidene)hydrazinyl)phen...)
Show SMILES [#6]-[#6](=O)-[#6](=[#7]/[#7]-c1cccc(c1)-n1nc(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c(-[#6](=O)-[#7]-c2nnc(s2)S([#7])(=O)=O)c1-c1ccccc1)\[#6](-[#6])=O
Show InChI InChI=1S/C26H22N12O8S4/c1-12(39)18(13(2)40)32-31-15-9-6-10-16(11-15)38-20(14-7-4-3-5-8-14)17(21(41)29-23-33-35-25(47-23)49(27,43)44)19(37-38)22(42)30-24-34-36-26(48-24)50(28,45)46/h3-11,31H,1-2H3,(H2,27,43,44)(H2,28,45,46)(H,29,33,41)(H,30,34,42)
PDB
MMDB

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Reactome pathway
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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
767n/an/an/an/an/an/an/an/a



Dumlupinar University



Assay Description
CA activity was measured according to the method described by Verpoorte et al. in inhibition studies, spectrophotometrically [Biochem., 242:4221-4229...


Bioorg Chem 68: 64-71 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.006
BindingDB Entry DOI: 10.7270/Q2N29VQC
More data for this
Ligand-Target Pair