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PubMed code 27982494

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
Plasma kallikrein


(Homo sapiens (Human))
BDBM218837
PNG
(TBMB-PK15 (10))
Show SMILES CSCc1cc(CSC)cc(CSC)c1
Show InChI InChI=1S/C12H18S3/c1-13-7-10-4-11(8-14-2)6-12(5-10)9-15-3/h4-6H,7-9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.30n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
Plasma kallikrein


(Homo sapiens (Human))
BDBM218839
PNG
(TBMT-FX618 (16) | TBMT-PK15 (12))
Show SMILES CSCc1nc(CSC)nc(CSC)n1
Show InChI InChI=1S/C9H15N3S3/c1-13-4-7-10-8(5-14-2)12-9(11-7)6-15-3/h4-6H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
20n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
Coagulation factor XII (FXII)


(Homo sapiens (Human))
BDBM218840
PNG
(TATA-FXII618 (14))
Show SMILES CSCCC(=O)N1CN(CN(C1)C(=O)CCSC)C(=O)CCSC
Show InChI InChI=1S/C15H27N3O3S3/c1-22-7-4-13(19)16-10-17(14(20)5-8-23-2)12-18(11-16)15(21)6-9-24-3/h4-12H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
25n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
Coagulation factor XII (FXII)


(Homo sapiens (Human))
BDBM218838
PNG
(TATB-FXII618 (15) | TATB-PK15 (11))
Show SMILES CSCC(=O)N1CN(CN(C1)C(=O)CSC)C(=O)CSC
Show InChI InChI=1S/C12H21N3O3S3/c1-19-4-10(16)13-7-14(11(17)5-20-2)9-15(8-13)12(18)6-21-3/h4-9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
340n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
Plasma kallikrein


(Homo sapiens (Human))
BDBM218838
PNG
(TATB-FXII618 (15) | TATB-PK15 (11))
Show SMILES CSCC(=O)N1CN(CN(C1)C(=O)CSC)C(=O)CSC
Show InChI InChI=1S/C12H21N3O3S3/c1-19-4-10(16)13-7-14(11(17)5-20-2)9-15(8-13)12(18)6-21-3/h4-9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
540n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
Coagulation factor XII (FXII)


(Homo sapiens (Human))
BDBM218839
PNG
(TBMT-FX618 (16) | TBMT-PK15 (12))
Show SMILES CSCc1nc(CSC)nc(CSC)n1
Show InChI InChI=1S/C9H15N3S3/c1-13-4-7-10-8(5-14-2)12-9(11-7)6-15-3/h4-6H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.22E+3n/an/an/an/an/an/a7.4n/a



University of Glasgow



Assay Description
The inhibition of plasma kallikrein and coagulation factor FXII was assessed by incubating the proteases with bicyclic peptide (twofold dilutions) an...


Chembiochem 18: 387-395 (2017)


Article DOI: 10.1002/cbic.201600612
BindingDB Entry DOI: 10.7270/Q2H9942B
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%