BindingDB logo
myBDB logout

PubMed code 26564266

Compile data set for download or QSAR
Found 22 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
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50022815
PNG
((3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33...)
Show SMILES CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C |r|
Show InChI InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
KEGG
MMDB
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 23n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50295455
PNG
(1-(2,6-Dihydroxybenzoyl)-3-(9H-fluoren-9-yl)-urea ...)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H16N2O4/c24-16-10-5-11-17(25)18(16)20(26)23-21(27)22-19-14-8-3-1-6-12(14)13-7-2-4-9-15(13)19/h1-11,19,24-25H,(H2,22,23,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 32n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50295465
PNG
(1-(2-Fluorobenzoyl)-3-(9H-fluoren-9-yl)-urea | CHE...)
Show SMILES Fc1ccccc1C(=O)NC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H15FN2O2/c22-18-12-6-5-11-17(18)20(25)24-21(26)23-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1-12,19H,(H2,23,24,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 159n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50295468
PNG
(1-(2,6-Difluorobenzoyl)-3-(9H-fluoren-9-yl)-urea |...)
Show SMILES Fc1cccc(F)c1C(=O)NC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H14F2N2O2/c22-16-10-5-11-17(23)18(16)20(26)25-21(27)24-19-14-8-3-1-6-12(14)13-7-2-4-9-15(13)19/h1-11,19H,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
Article
PubMed
n/an/a 263n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499896
PNG
(CHEMBL3739446)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2cccc(F)c12
Show InChI InChI=1S/C21H15FN2O4/c22-14-8-3-7-12-11-5-1-2-6-13(11)19(17(12)14)23-21(28)24-20(27)18-15(25)9-4-10-16(18)26/h1-10,19,25-26H,(H2,23,24,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 940n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499890
PNG
(CHEMBL3741169)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2cc(Cl)ccc12
Show InChI InChI=1S/C21H15ClN2O4/c22-11-8-9-14-15(10-11)12-4-1-2-5-13(12)19(14)23-21(28)24-20(27)18-16(25)6-3-7-17(18)26/h1-10,19,25-26H,(H2,23,24,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.22E+3n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499893
PNG
(CHEMBL3741556)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2cc(F)ccc12
Show InChI InChI=1S/C21H15FN2O4/c22-11-8-9-14-15(10-11)12-4-1-2-5-13(12)19(14)23-21(28)24-20(27)18-16(25)6-3-7-17(18)26/h1-10,19,25-26H,(H2,23,24,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.76E+3n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499882
PNG
(CHEMBL3739694)
Show SMILES Cc1ccc2C(NC(=O)NC(=O)c3ccccc3F)c3ccccc3-c2c1
Show InChI InChI=1S/C22H17FN2O2/c1-13-10-11-16-18(12-13)14-6-2-3-7-15(14)20(16)24-22(27)25-21(26)17-8-4-5-9-19(17)23/h2-12,20H,1H3,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499895
PNG
(CHEMBL3741750)
Show SMILES Fc1ccccc1C(=O)NC(=O)NC1C2CCCCC2c2ccccc12
Show InChI InChI=1S/C21H21FN2O2/c22-18-12-6-5-11-17(18)20(25)24-21(26)23-19-15-9-3-1-7-13(15)14-8-2-4-10-16(14)19/h1,3,5-7,9,11-12,14,16,19H,2,4,8,10H2,(H2,23,24,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499892
PNG
(CHEMBL3741269)
Show SMILES Oc1ccc(F)cc1C(=O)NC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H15FN2O3/c22-12-9-10-18(25)17(11-12)20(26)24-21(27)23-19-15-7-3-1-5-13(15)14-6-2-4-8-16(14)19/h1-11,19,25H,(H2,23,24,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499884
PNG
(CHEMBL3742256)
Show SMILES Oc1ccc(C(=O)NC(=O)NC2c3ccccc3-c3ccccc23)c(O)c1
Show InChI InChI=1S/C21H16N2O4/c24-12-9-10-17(18(25)11-12)20(26)23-21(27)22-19-15-7-3-1-5-13(15)14-6-2-4-8-16(14)19/h1-11,19,24-25H,(H2,22,23,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499889
PNG
(CHEMBL3740420)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2cc3ccccc3cc12
Show InChI InChI=1S/C25H18N2O4/c28-20-10-5-11-21(29)22(20)24(30)27-25(31)26-23-17-9-4-3-8-16(17)18-12-14-6-1-2-7-15(14)13-19(18)23/h1-13,23,28-29H,(H2,26,27,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499883
PNG
(CHEMBL3742124)
Show SMILES Fc1ccccc1CNC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H17FN2O/c22-19-12-6-1-7-14(19)13-23-21(25)24-20-17-10-4-2-8-15(17)16-9-3-5-11-18(16)20/h1-12,20H,13H2,(H2,23,24,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499899
PNG
(CHEMBL3741032)
Show SMILES Oc1cccc(O)c1CNC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C21H18N2O3/c24-18-10-5-11-19(25)17(18)12-22-21(26)23-20-15-8-3-1-6-13(15)14-7-2-4-9-16(14)20/h1-11,20,24-25H,12H2,(H2,22,23,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499894
PNG
(CHEMBL3740233)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1C2CCCCC2c2ccccc12
Show InChI InChI=1S/C21H22N2O4/c24-16-10-5-11-17(25)18(16)20(26)23-21(27)22-19-14-8-3-1-6-12(14)13-7-2-4-9-15(13)19/h1,3,5-6,8,10-11,13,15,19,24-25H,2,4,7,9H2,(H2,22,23,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499885
PNG
(CHEMBL3742326)
Show SMILES Fc1ccccc1CC(=O)NC(=O)NC1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C22H17FN2O2/c23-19-12-6-1-7-14(19)13-20(26)24-22(27)25-21-17-10-4-2-8-15(17)16-9-3-5-11-18(16)21/h1-12,21H,13H2,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499887
PNG
(CHEMBL3741871)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccccc2-c2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C22H15F3N2O4/c23-22(24,25)11-8-9-14-15(10-11)12-4-1-2-5-13(12)19(14)26-21(31)27-20(30)18-16(28)6-3-7-17(18)29/h1-10,19,28-29H,(H2,26,27,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499897
PNG
(CHEMBL3739918)
Show SMILES Fc1ccc2C(NC(=O)NC(=O)c3ccccc3F)c3ccccc3-c2c1
Show InChI InChI=1S/C21H14F2N2O2/c22-12-9-10-15-17(11-12)13-5-1-2-6-14(13)19(15)24-21(27)25-20(26)16-7-3-4-8-18(16)23/h1-11,19H,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.03E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499898
PNG
(CHEMBL3739929)
Show SMILES Oc1cccc(O)c1C(=O)NC(=O)NC1c2ccc(F)cc2-c2ccc(F)cc12
Show InChI InChI=1S/C21H14F2N2O4/c22-10-5-7-13-14(8-10)12-6-4-11(23)9-15(12)19(13)24-21(29)25-20(28)18-16(26)2-1-3-17(18)27/h1-9,19,26-27H,(H2,24,25,28,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.03E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499891
PNG
(CHEMBL3739557)
Show SMILES Fc1cccc2-c3ccccc3C(NC(=O)NC(=O)c3ccccc3F)c12
Show InChI InChI=1S/C21H14F2N2O2/c22-16-10-4-3-8-15(16)20(26)25-21(27)24-19-14-7-2-1-6-12(14)13-9-5-11-17(23)18(13)19/h1-11,19H,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.04E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499888
PNG
(CHEMBL3742351)
Show SMILES Fc1ccccc1C(=O)NC(=O)NC1c2ccccc2-c2cc(Cl)ccc12
Show InChI InChI=1S/C21H14ClFN2O2/c22-12-9-10-15-17(11-12)13-5-1-2-6-14(13)19(15)24-21(27)25-20(26)16-7-3-4-8-18(16)23/h1-11,19H,(H2,24,25,26,27)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.08E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))		BDBM50499886
PNG
(CHEMBL3739567)
Show SMILES Cc1ccc2C(NC(=O)NC(=O)c3c(O)cccc3O)c3ccccc3-c2c1
Show InChI InChI=1S/C22H18N2O4/c1-12-9-10-15-16(11-12)13-5-2-3-6-14(13)20(15)23-22(28)24-21(27)19-17(25)7-4-8-18(19)26/h2-11,20,25-26H,1H3,(H2,23,24,27,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.16E+4n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of CypA (unknown origin) assessed as peptidyl-prolyl cis-trans isomerase activity using N-succinyl-Ala-Ala-Pro-Phe-p-nitroanilide as subst...

Bioorg Med Chem Lett 25: 5682-6 (2015)


Article DOI: 10.1016/j.bmcl.2015.11.002
BindingDB Entry DOI: 10.7270/Q27S7RSS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%