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Compile Data Set for Download or QSAR

Found 45 hits Enz. Inhib. hit(s) with Target = 'Endoplasmic reticulum aminopeptidase 1' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076744
PNG
(CHEMBL3416733)
Show SMILES CC(C)C[C@H](CP(O)(=O)[C@@H](N)CCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
Show InChI InChI=1/C27H37N4O4P/c1-18(2)14-21(17-36(34,35)25(28)13-12-19-8-4-3-5-9-19)27(33)31-24(26(29)32)15-20-16-30-23-11-7-6-10-22(20)23/h3-11,16,18,21,24-25,30H,12-15,17,28H2,1-2H3,(H2,29,32)(H,31,33)(H,34,35)/t21-,24+,25-/s2
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n/an/a 33n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076984
PNG
(CHEMBL3416720)
Show SMILES N[C@@H](CCc1ccc(O)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C28H29N5O5/c29-21(11-7-16-5-9-19(34)10-6-16)27(36)32-24-12-8-17(13-22(24)30)26(35)33-25(28(37)38)14-18-15-31-23-4-2-1-3-20(18)23/h1-6,8-10,12-13,15,21,25,31,34H,7,11,14,29-30H2,(H,32,36)(H,33,35)(H,37,38)/t21-,25-/s2
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n/an/a 800n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077028
PNG
(CHEMBL3416692)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C31H35N5O4/c1-2-3-12-25(33)30(38)35-27-16-21(14-15-24(27)32)29(37)36-28(31(39)40-19-20-9-5-4-6-10-20)17-22-18-34-26-13-8-7-11-23(22)26/h4-11,13-16,18,25,28,34H,2-3,12,17,19,32-33H2,1H3,(H,35,38)(H,36,37)/t25-,28-/s2
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n/an/a 920n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076981
PNG
(CHEMBL3416716)
Show SMILES N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C41H39N5O5/c42-34-22-30(17-20-37(34)45-40(48)35(43)21-27-15-18-32(19-16-27)50-25-28-9-3-1-4-10-28)39(47)46-38(41(49)51-26-29-11-5-2-6-12-29)23-31-24-44-36-14-8-7-13-33(31)36/h1-20,22,24,35,38,44H,21,23,25-26,42-43H2,(H,45,48)(H,46,47)/t35-,38-/s2
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n/an/a 1.10E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076972
PNG
(CHEMBL3416697)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C24H30N8O4/c25-16-8-7-13(10-19(16)31-22(34)17(26)5-3-9-29-24(27)28)21(33)32-20(23(35)36)11-14-12-30-18-6-2-1-4-15(14)18/h1-2,4,6-8,10,12,17,20,30H,3,5,9,11,25-26H2,(H,31,34)(H,32,33)(H,35,36)(H4,27,28,29)/t17-,20-/s2
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n/an/a 1.20E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50439354
PNG
(CHEMBL2420381)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1
Show InChI InChI=1S/C24H33N5O4/c1-33-24(32)20(9-5-6-14-25)28-22(30)17-11-13-18(26)21(15-17)29-23(31)19(27)12-10-16-7-3-2-4-8-16/h2-4,7-8,11,13,15,19-20H,5-6,9-10,12,14,25-27H2,1H3,(H,28,30)(H,29,31)/t19-,20-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of recombinant ERAP1 (unknown origin) expressed in baculovirus-infected Hi5 insect cells assessed as L-Leucine-7-amido-4-methyl coumarin h...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077018
PNG
(CHEMBL3416726)
Show SMILES CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C31H35N5O4/c1-2-3-12-24(32)30(38)35-27-15-14-21(16-25(27)33)29(37)36-28(31(39)40-19-20-9-5-4-6-10-20)17-22-18-34-26-13-8-7-11-23(22)26/h4-11,13-16,18,24,28,34H,2-3,12,17,19,32-33H2,1H3,(H,35,38)(H,36,37)/t24-,28-/s2
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n/an/a 2.50E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50439353
PNG
(CHEMBL2420382)
Show SMILES NCCCC[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(O)=O
Show InChI InChI=1S/C23H31N5O4/c24-13-5-4-8-19(23(31)32)27-21(29)16-10-12-17(25)20(14-16)28-22(30)18(26)11-9-15-6-2-1-3-7-15/h1-3,6-7,10,12,14,18-19H,4-5,8-9,11,13,24-26H2,(H,27,29)(H,28,30)(H,31,32)/t18-,19-/m0/s1
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n/an/a 2.60E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of recombinant ERAP1 (unknown origin) expressed in baculovirus-infected Hi5 insect cells assessed as L-Leucine-7-amido-4-methyl coumarin h...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077020
PNG
(CHEMBL3416729)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)CCCNC(N)=N)c(N)c1
Show InChI InChI=1/C23H31N7O5/c1-35-22(34)19(11-13-4-7-15(31)8-5-13)30-20(32)14-6-9-18(17(25)12-14)29-21(33)16(24)3-2-10-28-23(26)27/h4-9,12,16,19,31H,2-3,10-11,24-25H2,1H3,(H,29,33)(H,30,32)(H4,26,27,28)/t16-,19-/s2
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n/an/a 2.60E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077019
PNG
(CHEMBL3416727)
Show SMILES CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C24H29N5O4/c1-2-3-7-17(25)23(31)28-20-10-9-14(11-18(20)26)22(30)29-21(24(32)33)12-15-13-27-19-8-5-4-6-16(15)19/h4-6,8-11,13,17,21,27H,2-3,7,12,25-26H2,1H3,(H,28,31)(H,29,30)(H,32,33)/t17-,21-/s2
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n/an/a 2.80E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077029
PNG
(CHEMBL3416693)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C24H29N5O4/c1-2-3-7-18(26)23(31)28-20-11-14(9-10-17(20)25)22(30)29-21(24(32)33)12-15-13-27-19-8-5-4-6-16(15)19/h4-6,8-11,13,18,21,27H,2-3,7,12,25-26H2,1H3,(H,28,31)(H,29,30)(H,32,33)/t18-,21-/s2
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n/an/a 3.60E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076958
PNG
(CHEMBL3416583)
Show SMILES CC(C)C[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCCN)C(O)=O
Show InChI InChI=1/C19H31N5O4/c1-11(2)9-14(22)18(26)24-16-10-12(6-7-13(16)21)17(25)23-15(19(27)28)5-3-4-8-20/h6-7,10-11,14-15H,3-5,8-9,20-22H2,1-2H3,(H,23,25)(H,24,26)(H,27,28)/t14-,15-/s2
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n/an/a 6.80E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50439351
PNG
(CHEMBL2420384)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1
Show InChI InChI=1S/C27H30N4O5/c1-36-27(35)24(15-18-7-11-20(32)12-8-18)31-25(33)19-10-14-21(28)23(16-19)30-26(34)22(29)13-9-17-5-3-2-4-6-17/h2-8,10-12,14,16,22,24,32H,9,13,15,28-29H2,1H3,(H,30,34)(H,31,33)/t22-,24-/m0/s1
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n/an/a 7.70E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of recombinant ERAP1 (unknown origin) expressed in baculovirus-infected Hi5 insect cells assessed as L-Leucine-7-amido-4-methyl coumarin h...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077015
PNG
(CHEMBL3416721)
Show SMILES CC(C)C[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C31H35N5O4/c1-19(2)14-25(33)30(38)35-27-13-12-21(15-24(27)32)29(37)36-28(31(39)40-18-20-8-4-3-5-9-20)16-22-17-34-26-11-7-6-10-23(22)26/h3-13,15,17,19,25,28,34H,14,16,18,32-33H2,1-2H3,(H,35,38)(H,36,37)/t25-,28-/s2
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n/an/a 8.90E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076977
PNG
(CHEMBL3416711)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1
Show InChI InChI=1/C27H30N4O5/c1-36-27(35)24(15-18-7-11-20(32)12-8-18)31-25(33)19-10-14-23(22(29)16-19)30-26(34)21(28)13-9-17-5-3-2-4-6-17/h2-8,10-12,14,16,21,24,32H,9,13,15,28-29H2,1H3,(H,30,34)(H,31,33)/t21-,24-/s2
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n/an/a 9.40E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076971
PNG
(CHEMBL3416696)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCCNC(N)=N)c1
Show InChI InChI=1/C23H31N7O5/c1-35-22(34)19(11-13-4-7-15(31)8-5-13)30-20(32)14-6-9-16(24)18(12-14)29-21(33)17(25)3-2-10-28-23(26)27/h4-9,12,17,19,31H,2-3,10-11,24-25H2,1H3,(H,29,33)(H,30,32)(H4,26,27,28)/t17-,19-/s2
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n/an/a 9.60E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076969
PNG
(CHEMBL3416685)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C34H33N5O5/c35-27-15-12-23(17-30(27)38-33(42)28(36)16-21-10-13-25(40)14-11-21)32(41)39-31(34(43)44-20-22-6-2-1-3-7-22)18-24-19-37-29-9-5-4-8-26(24)29/h1-15,17,19,28,31,37,40H,16,18,20,35-36H2,(H,38,42)(H,39,41)/t28-,31-/s2
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n/an/a 9.80E+3n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076970
PNG
(CHEMBL3416694)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)OC
Show InChI InChI=1/C20H33N7O4/c1-3-4-6-14(22)18(29)27-16-11-12(8-9-13(16)21)17(28)26-15(19(30)31-2)7-5-10-25-20(23)24/h8-9,11,14-15H,3-7,10,21-22H2,1-2H3,(H,26,28)(H,27,29)(H4,23,24,25)/t14-,15-/s2
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n/an/a 1.07E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076979
PNG
(CHEMBL3416713)
Show SMILES COC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1
Show InChI InChI=1/C24H33N7O4/c1-35-23(34)20(8-5-13-29-24(27)28)31-21(32)16-10-12-19(18(26)14-16)30-22(33)17(25)11-9-15-6-3-2-4-7-15/h2-4,6-7,10,12,14,17,20H,5,8-9,11,13,25-26H2,1H3,(H,30,33)(H,31,32)(H4,27,28,29)/t17-,20-/s2
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n/an/a 1.20E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077023
PNG
(CHEMBL3416686)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C27H27N5O5/c28-20-10-7-16(12-23(20)31-26(35)21(29)11-15-5-8-18(33)9-6-15)25(34)32-24(27(36)37)13-17-14-30-22-4-2-1-3-19(17)22/h1-10,12,14,21,24,30,33H,11,13,28-29H2,(H,31,35)(H,32,34)(H,36,37)/t21-,24-/s2
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n/an/a 1.21E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076978
PNG
(CHEMBL3416712)
Show SMILES N[C@@H](CCc1ccccc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C35H35N5O4/c36-28(17-15-23-9-3-1-4-10-23)34(42)39-31-18-16-25(19-29(31)37)33(41)40-32(35(43)44-22-24-11-5-2-6-12-24)20-26-21-38-30-14-8-7-13-27(26)30/h1-14,16,18-19,21,28,32,38H,15,17,20,22,36-37H2,(H,39,42)(H,40,41)/t28-,32-/s2
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n/an/a 1.34E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076980
PNG
(CHEMBL3416715)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c(N)c1
Show InChI InChI=1/C26H28N4O6/c1-36-26(35)23(13-16-4-9-19(32)10-5-16)30-24(33)17-6-11-22(20(27)14-17)29-25(34)21(28)12-15-2-7-18(31)8-3-15/h2-11,14,21,23,31-32H,12-13,27-28H2,1H3,(H,29,34)(H,30,33)/t21-,23-/s2
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n/an/a 1.67E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076962
PNG
(CHEMBL3416584)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](CCCCN)C(=O)OC
Show InChI InChI=1/C20H33N5O4/c1-3-4-7-15(23)19(27)25-17-12-13(9-10-14(17)22)18(26)24-16(20(28)29-2)8-5-6-11-21/h9-10,12,15-16H,3-8,11,21-23H2,1-2H3,(H,24,26)(H,25,27)/t15-,16-/s2
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n/an/a 1.83E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076982
PNG
(CHEMBL3416717)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C27H27N5O5/c28-20-12-16(7-10-23(20)31-26(35)21(29)11-15-5-8-18(33)9-6-15)25(34)32-24(27(36)37)13-17-14-30-22-4-2-1-3-19(17)22/h1-10,12,14,21,24,30,33H,11,13,28-29H2,(H,31,35)(H,32,34)(H,36,37)/t21-,24-/s2
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n/an/a 1.95E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076976
PNG
(CHEMBL3416707)
Show SMILES COC(=O)[C@H](CCCNC(N)=N)NC(=O)c1ccc(N)c(N)c1
Show InChI InChI=1/C14H22N6O3/c1-23-13(22)11(3-2-6-19-14(17)18)20-12(21)8-4-5-9(15)10(16)7-8/h4-5,7,11H,2-3,6,15-16H2,1H3,(H,20,21)(H4,17,18,19)/t11-/s2
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n/an/a 3.50E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077021
PNG
(CHEMBL3416730)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C24H30N8O4/c25-16(5-3-9-29-24(27)28)22(34)31-19-8-7-13(10-17(19)26)21(33)32-20(23(35)36)11-14-12-30-18-6-2-1-4-15(14)18/h1-2,4,6-8,10,12,16,20,30H,3,5,9,11,25-26H2,(H,31,34)(H,32,33)(H,35,36)(H4,27,28,29)/t16-,20-/s2
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n/an/a 3.82E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077025
PNG
(CHEMBL3416688)
Show SMILES N[C@@H](CCc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C28H29N5O5/c29-21-12-8-17(13-24(21)32-27(36)22(30)11-7-16-5-9-19(34)10-6-16)26(35)33-25(28(37)38)14-18-15-31-23-4-2-1-3-20(18)23/h1-6,8-10,12-13,15,22,25,31,34H,7,11,14,29-30H2,(H,32,36)(H,33,35)(H,37,38)/t22-,25-/s2
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n/an/a 3.84E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076964
PNG
(CHEMBL3416585)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCCNC(N)=N)c1
Show InChI InChI=1/C20H34N8O4/c1-32-19(31)15(6-2-3-9-21)27-17(29)12-7-8-13(22)16(11-12)28-18(30)14(23)5-4-10-26-20(24)25/h7-8,11,14-15H,2-6,9-10,21-23H2,1H3,(H,27,29)(H,28,30)(H4,24,25,26)/t14-,15-/s2
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n/an/a 4.20E+4n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50439357
PNG
(CHEMBL2420378)
Show SMILES CC(C)[C@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccccc2)c1)C(=O)OCc1ccccc1
Show InChI InChI=1S/C29H34N4O4/c1-19(2)26(29(36)37-18-21-11-7-4-8-12-21)33-27(34)22-14-16-23(30)25(17-22)32-28(35)24(31)15-13-20-9-5-3-6-10-20/h3-12,14,16-17,19,24,26H,13,15,18,30-31H2,1-2H3,(H,32,35)(H,33,34)/t24-,26-/m0/s1
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n/an/a 9.55E+4n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of recombinant ERAP1 (unknown origin) expressed in baculovirus-infected Hi5 insect cells assessed as L-Leucine-7-amido-4-methyl coumarin h...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077024
PNG
(CHEMBL3416687)
Show SMILES N[C@@H](CCc1ccc(OCc2ccccc2)cc1)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1
Show InChI InChI=1/C42H41N5O5/c43-35-22-18-31(23-38(35)46-41(49)36(44)21-17-28-15-19-33(20-16-28)51-26-29-9-3-1-4-10-29)40(48)47-39(42(50)52-27-30-11-5-2-6-12-30)24-32-25-45-37-14-8-7-13-34(32)37/h1-16,18-20,22-23,25,36,39,45H,17,21,24,26-27,43-44H2,(H,46,49)(H,47,48)/t36-,39-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076968
PNG
(CHEMBL3416589)
Show SMILES COC(=O)[C@@H](NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1)[C@@H](C)O
Show InChI InChI=1/C21H26N4O6/c1-11(26)18(21(30)31-2)25-19(28)13-5-8-15(22)17(10-13)24-20(29)16(23)9-12-3-6-14(27)7-4-12/h3-8,10-11,16,18,26-27H,9,22-23H2,1-2H3,(H,24,29)(H,25,28)/t11-,16+,18+/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076956
PNG
(CHEMBL3416580)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(OCc3ccccc3)cc2)c1
Show InChI InChI=1/C31H39N5O5/c1-40-31(39)27(9-5-6-18-32)35-29(37)23-13-17-25(33)28(19-23)36-30(38)26(34)16-12-21-10-14-24(15-11-21)41-20-22-7-3-2-4-8-22/h2-4,7-8,10-11,13-15,17,19,26-27H,5-6,9,12,16,18,20,32-34H2,1H3,(H,35,37)(H,36,38)/t26-,27-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076955
PNG
(CHEMBL3416579)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(O)cc2)c1
Show InChI InChI=1/C24H33N5O5/c1-34-24(33)20(4-2-3-13-25)28-22(31)16-8-12-18(26)21(14-16)29-23(32)19(27)11-7-15-5-9-17(30)10-6-15/h5-6,8-10,12,14,19-20,30H,2-4,7,11,13,25-27H2,1H3,(H,28,31)(H,29,32)/t19-,20-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076814
PNG
(CHEMBL3416572)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)OC
Show InChI InChI=1/C14H21N3O3/c1-3-4-5-11(16)13(18)17-12-8-9(14(19)20-2)6-7-10(12)15/h6-8,11H,3-5,15-16H2,1-2H3,(H,17,18)/t11-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077022
PNG
(CHEMBL3416569)
Show SMILES COC(=O)c1ccc(N)c(NC(=O)[C@@H](N)CCc2ccc(O)cc2)c1
Show InChI InChI=1/C18H21N3O4/c1-25-18(24)12-5-9-14(19)16(10-12)21-17(23)15(20)8-4-11-2-6-13(22)7-3-11/h2-3,5-7,9-10,15,22H,4,8,19-20H2,1H3,(H,21,23)/t15-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076796
PNG
(CHEMBL3416567)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1cc(ccc1N)C(O)=O
Show InChI InChI=1/C16H17N3O4/c17-12-6-3-10(16(22)23)8-14(12)19-15(21)13(18)7-9-1-4-11(20)5-2-9/h1-6,8,13,20H,7,17-18H2,(H,19,21)(H,22,23)/t13-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077017
PNG
(CHEMBL3416725)
Show SMILES CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC
Show InChI InChI=1/C23H30N4O5/c1-3-4-5-17(24)22(30)26-19-11-8-15(13-18(19)25)21(29)27-20(23(31)32-2)12-14-6-9-16(28)10-7-14/h6-11,13,17,20,28H,3-5,12,24-25H2,1-2H3,(H,26,30)(H,27,29)/t17-,20-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077016
PNG
(CHEMBL3416723)
Show SMILES CCCC[C@H](N)C(=O)Nc1ccc(cc1N)C(=O)N[C@@H](C(C)C)C(=O)OCc1ccccc1
Show InChI InChI=1/C25H34N4O4/c1-4-5-11-19(26)24(31)28-21-13-12-18(14-20(21)27)23(30)29-22(16(2)3)25(32)33-15-17-9-7-6-8-10-17/h6-10,12-14,16,19,22H,4-5,11,15,26-27H2,1-3H3,(H,28,31)(H,29,30)/t19-,22-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076983
PNG
(CHEMBL3416718)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c(N)c1
Show InChI InChI=1/C23H31N5O5/c1-33-23(32)20(4-2-3-11-24)28-21(30)15-7-10-19(17(25)13-15)27-22(31)18(26)12-14-5-8-16(29)9-6-14/h5-10,13,18,20,29H,2-4,11-12,24-26H2,1H3,(H,27,31)(H,28,30)/t18-,20-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076974
PNG
(CHEMBL3416703)
Show SMILES COC(=O)[C@H](CCCCN)NC(=O)c1ccc(N)c(N)c1
Show InChI InChI=1/C14H22N4O3/c1-21-14(20)12(4-2-3-7-15)18-13(19)9-5-6-10(16)11(17)8-9/h5-6,8,12H,2-4,7,15-17H2,1H3,(H,18,19)/t12-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076975
PNG
(CHEMBL3416706)
Show SMILES Nc1ccc(cc1N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1/C18H18N4O3/c19-13-6-5-10(7-14(13)20)17(23)22-16(18(24)25)8-11-9-21-15-4-2-1-3-12(11)15/h1-7,9,16,21H,8,19-20H2,(H,22,23)(H,24,25)/t16-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077026
PNG
(CHEMBL3416689)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](C(C)C)C(=O)OCc1ccccc1
Show InChI InChI=1/C25H34N4O4/c1-4-5-11-20(27)24(31)28-21-14-18(12-13-19(21)26)23(30)29-22(16(2)3)25(32)33-15-17-9-7-6-8-10-17/h6-10,12-14,16,20,22H,4-5,11,15,26-27H2,1-3H3,(H,28,31)(H,29,30)/t20-,22-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50077027
PNG
(CHEMBL3416691)
Show SMILES CCCC[C@H](N)C(=O)Nc1cc(ccc1N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC
Show InChI InChI=1/C23H30N4O5/c1-3-4-5-18(25)22(30)26-19-13-15(8-11-17(19)24)21(29)27-20(23(31)32-2)12-14-6-9-16(28)10-7-14/h6-11,13,18,20,28H,3-5,12,24-25H2,1-2H3,(H,26,30)(H,27,29)/t18-,20-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076973
PNG
(CHEMBL3414595)
Show SMILES COC(=O)c1ccc(NC(=O)[C@@H](N)CCc2ccccc2)c(N)c1
Show InChI InChI=1/C18H21N3O3/c1-24-18(23)13-8-10-16(15(20)11-13)21-17(22)14(19)9-7-12-5-3-2-4-6-12/h2-6,8,10-11,14H,7,9,19-20H2,1H3,(H,21,22)/t14-/s2
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n/an/a>1.00E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens)
BDBM50076967
PNG
(CHEMBL3416588)
Show SMILES COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc(N)c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)c1
Show InChI InChI=1/C26H28N4O6/c1-36-26(35)23(13-16-4-9-19(32)10-5-16)30-24(33)17-6-11-20(27)22(14-17)29-25(34)21(28)12-15-2-7-18(31)8-3-15/h2-11,14,21,23,31-32H,12-13,27-28H2,1H3,(H,29,34)(H,30,33)/t21-,23-/s2
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n/an/a 1.10E+5n/an/an/an/an/an/a



National Center for Scientific Research"Demokritos"

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ERAP1 expressed in baculovirus infected Sf9 cells using L-leucine-7-amido-4-methyl coumarin as substrate after 5 to 1...


Citation and Details
More data for this
Ligand-Target Pair