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Compile Data Set for Download or QSAR

Found 9 hits with Last Name = 'inamori' and Initial = 'y'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carboxypeptidase A1


(Bos taurus (bovine))
BDBM50236983
PNG
(2-Hydroxy-cyclohepta-2,4,6-trienone | 2-hydroxycyc...)
Show SMILES Oc1cccccc1=O
Show InChI InChI=1S/C7H6O2/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H,8,9)
PDB
MMDB

KEGG

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MCE
KEGG
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Article
PubMed
n/an/a 2.73E+3n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bos taurus (bovine) pancrease carboxypeptidase A after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Carboxypeptidase A1


(Bos taurus (bovine))
BDBM50330794
PNG
(2-Hydroxy-4-isopropyl-cyclohepta-2,4,6-trienone | ...)
Show SMILES CC(C)c1cccc(=O)c(O)c1
Show InChI InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)
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KEGG

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CHEMBL
MCE
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Article
PubMed
n/an/a 2.76E+3n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bos taurus (bovine) pancrease carboxypeptidase A after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Collagenase ColG


(Clostridium histolyticum)
BDBM50330794
PNG
(2-Hydroxy-4-isopropyl-cyclohepta-2,4,6-trienone | ...)
Show SMILES CC(C)c1cccc(=O)c(O)c1
Show InChI InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)
PDB
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CHEMBL
MCE
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UniChem

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Article
PubMed
n/an/a 2.40E+4n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Clostridium histolyticum collagenase after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Collagenase ColG


(Clostridium histolyticum)
BDBM50236983
PNG
(2-Hydroxy-cyclohepta-2,4,6-trienone | 2-hydroxycyc...)
Show SMILES Oc1cccccc1=O
Show InChI InChI=1S/C7H6O2/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H,8,9)
PDB
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CHEMBL
MCE
KEGG
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Article
PubMed
n/an/a 4.68E+4n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Clostridium histolyticum collagenase after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Thermolysin


(Bacillus thermoproteolyticus)
BDBM50330794
PNG
(2-Hydroxy-4-isopropyl-cyclohepta-2,4,6-trienone | ...)
Show SMILES CC(C)c1cccc(=O)c(O)c1
Show InChI InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)
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CHEMBL
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Article
PubMed
n/an/a 6.10E+4n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bacillus thermoproteolyticus thermolysin after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Thermolysin


(Bacillus thermoproteolyticus)
BDBM50236983
PNG
(2-Hydroxy-cyclohepta-2,4,6-trienone | 2-hydroxycyc...)
Show SMILES Oc1cccccc1=O
Show InChI InChI=1S/C7H6O2/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H,8,9)
PDB
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CHEMBL
MCE
KEGG
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PC sid
PDB
UniChem

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Article
PubMed
n/an/a 7.11E+4n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bacillus thermoproteolyticus thermolysin after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Collagenase ColG


(Clostridium histolyticum)
BDBM50092158
PNG
(1,10-phenanthroline | CHEMBL415879 | US10669227, C...)
Show SMILES c1cnc2c(c1)ccc1cccnc21
Show InChI InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H
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Article
PubMed
n/an/a 1.85E+5n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Clostridium histolyticum collagenase after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
Thermolysin


(Bacillus thermoproteolyticus)
BDBM50092158
PNG
(1,10-phenanthroline | CHEMBL415879 | US10669227, C...)
Show SMILES c1cnc2c(c1)ccc1cccnc21
Show InChI InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H
PDB
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CHEMBL
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PDB
Article
PubMed
n/an/a 3.60E+5n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bacillus thermoproteolyticus thermolysin after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carboxypeptidase A1


(Bos taurus (bovine))
BDBM50092158
PNG
(1,10-phenanthroline | CHEMBL415879 | US10669227, C...)
Show SMILES c1cnc2c(c1)ccc1cccnc21
Show InChI InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


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Article
PubMed
n/an/a 4.22E+5n/an/an/an/an/an/a



Osaka Organic Chemical Industry, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Bos taurus (bovine) pancrease carboxypeptidase A after 15 min


Biol Pharm Bull 26: 1487-90 (2003)


Article DOI: 10.1248/bpb.26.1487
BindingDB Entry DOI: 10.7270/Q2G163RP
More data for this
Ligand-Target Pair