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Compile Data Set for Download or QSAR

Found 20 hits with Last Name = 'dillemuth' and Initial = 'pmj'   
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
Prolyl endopeptidase


(Sus scrofa)
BDBM50155838
PNG
((S)-1-((S)-1-(4-phenylbutanoyl)pyrrolidine-2-carbo...)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1C#N
Show InChI InChI=1S/C20H25N3O2/c21-15-17-10-5-13-22(17)20(25)18-11-6-14-23(18)19(24)12-4-9-16-7-2-1-3-8-16/h1-3,7-8,17-18H,4-6,9-14H2/t17-,18-/m0/s1
PDB

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UniProtKB/SwissProt

DrugBank
GoogleScholar
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CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/a 0.200n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prolyl endopeptidase


(Sus scrofa)
BDBM50037604
PNG
(1-{(S)-2-[(S)-2-(1H-Imidazole-2-carbonyl)-pyrrolid...)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)c1ncc[nH]1
Show InChI InChI=1S/C23H28N4O3/c28-20(12-4-9-17-7-2-1-3-8-17)26-15-6-11-19(26)23(30)27-16-5-10-18(27)21(29)22-24-13-14-25-22/h1-3,7-8,13-14,18-19H,4-6,9-12,15-16H2,(H,24,25)/t18-,19-/m0/s1
PDB

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UniProtKB/SwissProt

DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572237
PNG
(CHEMBL4862396)
Show SMILES O=C(CCCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1ncc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572235
PNG
(CHEMBL4873431)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1ncc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572234
PNG
(CHEMBL4861124)
Show SMILES O=C(CCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1ncc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572238
PNG
(CHEMBL4852321)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1cnc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 44n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572227
PNG
(CHEMBL4849453)
Show SMILES O=C(CCCc1cccs1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 94n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572225
PNG
(CHEMBL4858172)
Show SMILES O=C(CCCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 770n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572222
PNG
(CHEMBL4859665)
Show SMILES O=C(CCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572228
PNG
(CHEMBL4846851)
Show SMILES C[C@H](NC(=O)CCCc1cccs1)C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572233
PNG
(CHEMBL4853692)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1cnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572236
PNG
(CHEMBL4878846)
Show SMILES C[C@H](NC(=O)CCCc1ccccc1)C(=O)N1CCC[C@H]1c1ncc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572223
PNG
(CHEMBL4861357)
Show SMILES C[C@H](NC(=O)CCc1ccccc1)C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.90E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572226
PNG
(CHEMBL4876083)
Show SMILES C[C@H](NC(=O)CCCCc1ccccc1)C(=O)N1CCC[C@H]1c1nnn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572230
PNG
(CHEMBL4852805)
Show SMILES Cn1nnc(n1)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572231
PNG
(CHEMBL4857482)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1nnc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.90E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572232
PNG
(CHEMBL4860555)
Show SMILES C[C@H](NC(=O)CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nnc[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.50E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572224
PNG
(CHEMBL4867363)
Show SMILES CN(CC(=O)N1CCC[C@H]1c1nnn[nH]1)C(=O)CCc1ccccc1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.20E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572239
PNG
(CHEMBL4864967)
Show SMILES O=C(CCCc1ccccc1)N1CCC[C@H]1C(=O)N1CCC[C@H]1c1ccn[nH]1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Sus scrofa)
BDBM50572229
PNG
(CHEMBL4864903)
Show SMILES Cn1nnnc1[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CCCc1ccccc1 |r|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.20E+5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant porcine PREP expressed in Escherichia coli using Suc-Gly-Pro-AMC as substrate preincubated for 30 mins followed by substrat...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00399
BindingDB Entry DOI: 10.7270/Q20V8HK3
More data for this
Ligand-Target Pair