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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
pH (Enzymatic Assay)
pH (ITC)
Substrate or Competitor
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Ki
IC50
Kd
EC50
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Compile Data Set for Download or QSAR
Found
13
hits of ki for monomerid = 50323741
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Carbonic anhydrase 5A, mitochondrial
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
44
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 5A by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 4
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
52
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 4 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
380
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 9 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 7
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
420
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 7 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
450
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 12 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 3
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 3 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 14
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 14 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 5B, mitochondrial
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
540
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 5B by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 13
(Mus musculus (mouse))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
630
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of mouse carbonic anhydrase 13 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 15
(Mus musculus)
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
650
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of mouse carbonic anhydrase 15 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 6
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
740
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 6 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
1.10E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM50323741
(CHEMBL119296)
Show SMILES
NCCCCCN
Show InChI
InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
1.33E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration method
J Med Chem
53:
5511
-
22
(2010)
Article DOI:
10.1021/jm1003667
BindingDB Entry DOI:
10.7270/Q22N52FB
More data for this
Ligand-Target Pair