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Compile Data Set for Download or QSAR

Found 81 hits of ki for UniProtKB: P00752   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Glandular kallikrein


(Sus scrofa)		BDBM50010135
PNG
(CHEMBL548400)
Show SMILES NC(=N)c1ccc(OCc2cccc(COc3ccc(cc3I)C(N)=N)c2)c(I)c1
Show InChI InChI=1S/C22H20I2N4O2/c23-17-9-15(21(25)26)4-6-19(17)29-11-13-2-1-3-14(8-13)12-30-20-7-5-16(22(27)28)10-18(20)24/h1-10H,11-12H2,(H3,25,26)(H3,27,28)
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 31n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BPPANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010130
PNG
(CHEMBL3245418)
Show SMILES NC(=N)c1ccc(OCc2cc(COc3ccc(cc3I)C(N)=N)cc(COc3ccc(cc3I)C(N)=N)c2)c(I)c1
Show InChI InChI=1S/C30H27I3N6O3/c31-22-10-19(28(34)35)1-4-25(22)40-13-16-7-17(14-41-26-5-2-20(29(36)37)11-23(26)32)9-18(8-16)15-42-27-6-3-21(30(38)39)12-24(27)33/h1-12H,13-15H2,(H3,34,35)(H3,36,37)(H3,38,39)
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 39n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein

J Med Chem 21: 1132-6 (1979)


BindingDB Entry DOI: 10.7270/Q2TT4SGN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50379838
PNG
(CHEMBL2011750)
Show SMILES NC(=N)c1ccc(OCc2ccc(COc3ccc(cc3I)C(N)=N)cc2)c(I)c1
Show InChI InChI=1S/C22H20I2N4O2/c23-17-9-15(21(25)26)5-7-19(17)29-11-13-1-2-14(4-3-13)12-30-20-8-6-16(22(27)28)10-18(20)24/h1-10H,11-12H2,(H3,25,26)(H3,27,28)
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 610n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BPPANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016540
PNG
(CHEMBL3277922)
Show SMILES Cl.NC(=N)c1ccc(OCc2ccc(COc3ccc(cc3Br)C(N)=N)cc2)c(Br)c1
Show InChI InChI=1S/C22H20Br2N4O2.ClH/c23-17-9-15(21(25)26)5-7-19(17)29-11-13-1-2-14(4-3-13)12-30-20-8-6-16(22(27)28)10-18(20)24;/h1-10H,11-12H2,(H3,25,26)(H3,27,28);1H
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 710n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010025
PNG
(CHEMBL352923)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2ccc(cc2s1)C(N)=N
Show InChI InChI=1S/C16H14N4S/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13/h1-8H,(H3,17,18)(H3,19,20)
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 730n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using N-benzoyl-L-prolyl-L-phenylalanyl-L-arginine p-nitroanilide hydrochloride as...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010025
PNG
(CHEMBL352923)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2ccc(cc2s1)C(N)=N
Show InChI InChI=1S/C16H14N4S/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13/h1-8H,(H3,17,18)(H3,19,20)
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 730n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016538
PNG
(CHEMBL3277933)
Show SMILES Cl.NC(=N)c1ccc(OCc2cc(COc3ccc(cc3)C(N)=N)c3ccccc3c2)cc1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)18-5-9-22(10-6-18)31-15-17-13-20-3-1-2-4-24(20)21(14-17)16-32-23-11-7-19(8-12-23)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 1.04E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016544
PNG
(CHEMBL3277934)
Show SMILES Cl.NC(=N)c1ccc(OCc2cccc(c2)-c2cccc(COc3ccc(cc3)C(N)=N)c2)cc1
Show InChI InChI=1S/C28H26N4O2.ClH/c29-27(30)21-7-11-25(12-8-21)33-17-19-3-1-5-23(15-19)24-6-2-4-20(16-24)18-34-26-13-9-22(10-14-26)28(31)32;/h1-16H,17-18H2,(H3,29,30)(H3,31,32);1H
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 1.60E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016539
PNG
(CHEMBL3277936)
Show SMILES Cl.NC(=N)c1cccc(OCc2cccc(c2)-c2cccc(COc3cccc(c3)C(N)=N)c2)c1
Show InChI InChI=1S/C28H26N4O2.ClH/c29-27(30)23-9-3-11-25(15-23)33-17-19-5-1-7-21(13-19)22-8-2-6-20(14-22)18-34-26-12-4-10-24(16-26)28(31)32;/h1-16H,17-18H2,(H3,29,30)(H3,31,32);1H
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 1.76E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010136
PNG
(CHEMBL3245422)
Show SMILES NC(=N)c1ccc(OCc2cccc(c2)-c2cccc(COc3ccc(cc3Br)C(N)=N)c2)c(Br)c1
Show InChI InChI=1S/C28H24Br2N4O2/c29-23-13-21(27(31)32)7-9-25(23)35-15-17-3-1-5-19(11-17)20-6-2-4-18(12-20)16-36-26-10-8-22(28(33)34)14-24(26)30/h1-14H,15-16H2,(H3,31,32)(H3,33,34)
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 2.20E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016530
PNG
(CHEMBL3277927)
Show SMILES Cl.NC(=N)c1cccc(COc2cccc3c(OCc4cccc(c4)C(N)=N)cccc23)c1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)19-7-1-5-17(13-19)15-31-23-11-3-10-22-21(23)9-4-12-24(22)32-16-18-6-2-8-20(14-18)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 2.20E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010056
PNG
(CHEMBL167255)
Show SMILES NC(=N)c1ccc2oc(\C=C\c3cc4cc(ccc4o3)C(N)=N)cc2c1
Show InChI InChI=1S/C20H16N4O2/c21-19(22)11-1-5-17-13(7-11)9-15(25-17)3-4-16-10-14-8-12(20(23)24)2-6-18(14)26-16/h1-10H,(H3,21,22)(H3,23,24)/b4-3+
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 2.37E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016537
PNG
(CHEMBL3277932)
Show SMILES Cl.NC(=N)c1ccc(OCc2ccc(COc3ccc(cc3)C(N)=N)c3ccccc23)cc1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)17-7-11-21(12-8-17)31-15-19-5-6-20(24-4-2-1-3-23(19)24)16-32-22-13-9-18(10-14-22)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 2.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010058
PNG
(CHEBI:51231 | DAPI)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2ccc(cc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)13-7-11-5-6-12(16(19)20)8-14(11)21-13/h1-8,21H,(H3,17,18)(H3,19,20)
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 2.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016536
PNG
(CHEMBL3277931)
Show SMILES Cl.NC(=N)c1ccc(COc2ccc3ccc(OCc4ccc(cc4)C(N)=N)cc3c2)cc1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)20-5-1-17(2-6-20)15-31-23-11-9-19-10-12-24(14-22(19)13-23)32-16-18-3-7-21(8-4-18)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 2.80E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016527
PNG
(CHEMBL3277924)
Show SMILES Cl.NC(=N)c1ccc(OCc2c(Cl)c(Cl)c(COc3ccc(cc3)C(N)=N)c(Cl)c2Cl)cc1
Show InChI InChI=1S/C22H18Cl4N4O2.ClH/c23-17-15(9-31-13-5-1-11(2-6-13)21(27)28)18(24)20(26)16(19(17)25)10-32-14-7-3-12(4-8-14)22(29)30;/h1-8H,9-10H2,(H3,27,28)(H3,29,30);1H
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 3.40E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016526
PNG
(CHEMBL3277921)
Show SMILES Cl.NC(=N)c1cccc(OCc2cccc(COc3cccc(c3)C(N)=N)c2)c1
Show InChI InChI=1S/C22H22N4O2.ClH/c23-21(24)17-6-2-8-19(11-17)27-13-15-4-1-5-16(10-15)14-28-20-9-3-7-18(12-20)22(25)26;/h1-12H,13-14H2,(H3,23,24)(H3,25,26);1H
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 3.40E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50027288
PNG
(2-{4-[3-(4-Carbamimidoyl-phenoxy)-propoxy]-phenyl}...)
Show SMILES NC(=N)c1ccc(OCCCOc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(N)=N)cc1
Show InChI InChI=1S/C24H24N6O2/c25-22(26)15-2-7-18(8-3-15)31-12-1-13-32-19-9-4-16(5-10-19)24-29-20-11-6-17(23(27)28)14-21(20)30-24/h2-11,14H,1,12-13H2,(H3,25,26)(H3,27,28)(H,29,30)
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 3.98E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010063
PNG
(CHEMBL1233459)
Show SMILES NC(=N)c1ccc(Oc2ccc(cc2)-c2nc3cc(ccc3[nH]2)C(N)=N)cc1
Show InChI InChI=1S/C21H18N6O/c22-19(23)12-1-6-15(7-2-12)28-16-8-3-13(4-9-16)21-26-17-10-5-14(20(24)25)11-18(17)27-21/h1-11H,(H3,22,23)(H3,24,25)(H,26,27)
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 4.11E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009969
PNG
(CHEMBL164489)
Show SMILES NC(=N)c1ccc(cc1)-c1ccc([nH]1)-c1ccc(cc1)C(N)=N
Show InChI InChI=1S/C18H17N5/c19-17(20)13-5-1-11(2-6-13)15-9-10-16(23-15)12-3-7-14(8-4-12)18(21)22/h1-10,23H,(H3,19,20)(H3,21,22)
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 4.65E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010009
PNG
(CHEMBL3251534)
Show SMILES NC(=N)c1ccc2oc(cc2c1)-c1cc2ccc(cc2[nH]1)C(N)=N
Show InChI InChI=1S/C18H15N5O/c19-17(20)10-3-4-15-12(5-10)8-16(24-15)14-6-9-1-2-11(18(21)22)7-13(9)23-14/h1-8,23H,(H3,19,20)(H3,21,22)
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 4.67E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010066
PNG
(CHEMBL167762)
Show SMILES NC(=N)c1cccc(c1)-c1cc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-2-9(6-10)14-8-12-7-11(16(19)20)4-5-13(12)21-14/h1-8,21H,(H3,17,18)(H3,19,20)
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 5.07E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50027284
PNG
(2-{4-[5-(4-Carbamimidoyl-phenoxy)-pentyloxy]-pheny...)
Show SMILES NC(=N)c1ccc(OCCCCCOc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(N)=N)cc1
Show InChI InChI=1S/C26H28N6O2/c27-24(28)17-4-9-20(10-5-17)33-14-2-1-3-15-34-21-11-6-18(7-12-21)26-31-22-13-8-19(25(29)30)16-23(22)32-26/h4-13,16H,1-3,14-15H2,(H3,27,28)(H3,29,30)(H,31,32)
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 5.16E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016528
PNG
(CHEMBL3277925)
Show SMILES Cl.NC(=N)c1ccc(OCc2c(Cl)c(Cl)c(Cl)c(COc3ccc(cc3)C(N)=N)c2Cl)cc1
Show InChI InChI=1S/C22H18Cl4N4O2.ClH/c23-17-15(9-31-13-5-1-11(2-6-13)21(27)28)18(24)20(26)19(25)16(17)10-32-14-7-3-12(4-8-14)22(29)30;/h1-8H,9-10H2,(H3,27,28)(H3,29,30);1H
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 5.20E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016532
PNG
(CHEMBL3277929)
Show SMILES Cl.NC(=N)c1cccc(COc2ccc3cc(OCc4cccc(c4)C(N)=N)ccc3c2)c1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)21-5-1-3-17(11-21)15-31-23-9-7-20-14-24(10-8-19(20)13-23)32-16-18-4-2-6-22(12-18)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 5.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016533
PNG
(CHEMBL3277930)
Show SMILES Cl.NC(=N)c1cccc(OCc2ccc3cc(COc4cccc(c4)C(N)=N)ccc3c2)c1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)21-3-1-5-23(13-21)31-15-17-7-9-20-12-18(8-10-19(20)11-17)16-32-24-6-2-4-22(14-24)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 5.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016524
PNG
(CHEMBL3277919)
Show SMILES Cl.NC(=N)c1cccc(OCc2ccc(COc3cccc(c3)C(N)=N)cc2)c1
Show InChI InChI=1S/C22H22N4O2.ClH/c23-21(24)17-3-1-5-19(11-17)27-13-15-7-9-16(10-8-15)14-28-20-6-2-4-18(12-20)22(25)26;/h1-12H,13-14H2,(H3,23,24)(H3,25,26);1H
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 5.80E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50027303
PNG
(2-{4-[4-(4-Carbamimidoyl-phenoxy)-butoxy]-phenyl}-...)
Show SMILES NC(=N)c1ccc(OCCCCOc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(N)=N)cc1
Show InChI InChI=1S/C25H26N6O2/c26-23(27)16-3-8-19(9-4-16)32-13-1-2-14-33-20-10-5-17(6-11-20)25-30-21-12-7-18(24(28)29)15-22(21)31-25/h3-12,15H,1-2,13-14H2,(H3,26,27)(H3,28,29)(H,30,31)
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 6.05E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016525
PNG
(CHEMBL3277920)
Show SMILES Cl.NC(=N)c1ccc(OCc2cccc(COc3ccc(cc3)C(N)=N)c2)cc1
Show InChI InChI=1S/C22H22N4O2.ClH/c23-21(24)17-4-8-19(9-5-17)27-13-15-2-1-3-16(12-15)14-28-20-10-6-18(7-11-20)22(25)26;/h1-12H,13-14H2,(H3,23,24)(H3,25,26);1H
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 6.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009976
PNG
(CHEMBL167801)
Show SMILES NC(=N)c1ccc(cc1)C1=Cc2ccc(cc2C1)C(N)=N |t:10|
Show InChI InChI=1S/C17H16N4/c18-16(19)11-3-1-10(2-4-11)14-7-12-5-6-13(17(20)21)8-15(12)9-14/h1-8H,9H2,(H3,18,19)(H3,20,21)
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 7.36E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009966
PNG
(CHEMBL164947)
Show SMILES NC(=N)c1ccc(NC(=O)c2cc3cc(ccc3s2)C(N)=N)cc1
Show InChI InChI=1S/C17H15N5OS/c18-15(19)9-1-4-12(5-2-9)22-17(23)14-8-11-7-10(16(20)21)3-6-13(11)24-14/h1-8H,(H3,18,19)(H3,20,21)(H,22,23)
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 7.76E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016529
PNG
(CHEMBL3277926)
Show SMILES Cl.NC(=N)c1ccc(COc2cccc3c(OCc4ccc(cc4)C(N)=N)cccc23)cc1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)19-11-7-17(8-12-19)15-31-23-5-1-3-21-22(23)4-2-6-24(21)32-16-18-9-13-20(14-10-18)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 8.60E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010029
PNG
(CHEMBL352553)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(ccc2s1)C(N)=N
Show InChI InChI=1S/C16H14N4S/c17-15(18)10-3-1-9(2-4-10)14-8-12-7-11(16(19)20)5-6-13(12)21-14/h1-8H,(H3,17,18)(H3,19,20)
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 8.68E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50010015
PNG
(3,5-Bis(4-Amidinophenyl)Isoxazole | CHEMBL388768)
Show SMILES NC(=N)c1ccc(cc1)-c1cc(on1)-c1ccc(cc1)C(N)=N
Show InChI InChI=1S/C17H15N5O/c18-16(19)12-5-1-10(2-6-12)14-9-15(23-22-14)11-3-7-13(8-4-11)17(20)21/h1-9H,(H3,18,19)(H3,20,21)
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 8.91E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009960
PNG
(CHEMBL354342)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(ccc2o1)C(N)=N
Show InChI InChI=1S/C16H14N4O/c17-15(18)10-3-1-9(2-4-10)14-8-12-7-11(16(19)20)5-6-13(12)21-14/h1-8H,(H3,17,18)(H3,19,20)
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 9.08E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50041220
PNG
(1,2-bis(5-amidinobenzofuran-2-yl)ethane | 2-(2-{5-...)
Show SMILES NC(=N)c1ccc2oc(CCc3cc4cc(ccc4o3)C(N)=N)cc2c1
Show InChI InChI=1S/C20H18N4O2/c21-19(22)11-1-5-17-13(7-11)9-15(25-17)3-4-16-10-14-8-12(20(23)24)2-6-18(14)26-16/h1-2,5-10H,3-4H2,(H3,21,22)(H3,23,24)
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 9.53E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016531
PNG
(CHEMBL3277928)
Show SMILES Cl.NC(=N)c1ccc(COc2ccc3cc(OCc4ccc(cc4)C(N)=N)ccc3c2)cc1
Show InChI InChI=1S/C26H24N4O2.ClH/c27-25(28)19-5-1-17(2-6-19)15-31-23-11-9-22-14-24(12-10-21(22)13-23)32-16-18-3-7-20(8-4-18)26(29)30;/h1-14H,15-16H2,(H3,27,28)(H3,29,30);1H
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 9.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009929
PNG
(CHEMBL167845)
Show SMILES NC(=N)c1ccc2oc(Cc3cc4cc(ccc4o3)C(N)=N)cc2c1
Show InChI InChI=1S/C19H16N4O2/c20-18(21)10-1-3-16-12(5-10)7-14(24-16)9-15-8-13-6-11(19(22)23)2-4-17(13)25-15/h1-8H,9H2,(H3,20,21)(H3,22,23)
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 1.06E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009930
PNG
(CHEMBL167761 | DB1171)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)14-8-12-7-11(16(19)20)5-6-13(12)21-14/h1-8,21H,(H3,17,18)(H3,19,20)
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 1.10E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50027285
PNG
(2-{4-[2-(4-Carbamimidoyl-phenoxy)-ethoxy]-phenyl}-...)
Show SMILES NC(=N)c1ccc(OCCOc2ccc(cc2)-c2nc3ccc(cc3[nH]2)C(N)=N)cc1
Show InChI InChI=1S/C23H22N6O2/c24-21(25)14-1-6-17(7-2-14)30-11-12-31-18-8-3-15(4-9-18)23-28-19-10-5-16(22(26)27)13-20(19)29-23/h1-10,13H,11-12H2,(H3,24,25)(H3,26,27)(H,28,29)
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 1.13E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50016523
PNG
(CHEMBL3277918)
Show SMILES Cl.NC(=N)c1ccc(OCc2ccc(COc3ccc(cc3)C(N)=N)cc2)cc1
Show InChI InChI=1S/C22H22N4O2.ClH/c23-21(24)17-5-9-19(10-6-17)27-13-15-1-2-16(4-3-15)14-28-20-11-7-18(8-12-20)22(25)26;/h1-12H,13-14H2,(H3,23,24)(H3,25,26);1H
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 1.14E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins

J Med Chem 19: 634-9 (1976)


BindingDB Entry DOI: 10.7270/Q2KD20FM
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009963
PNG
(CHEMBL165312)
Show SMILES NC(=N)c1cccc(c1)-c1cc2ccc(cc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)11-3-1-2-9(6-11)13-7-10-4-5-12(16(19)20)8-14(10)21-13/h1-8,21H,(H3,17,18)(H3,19,20)
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 1.23E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009964
PNG
(CHEMBL3251194)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(cc(C(N)=N)c2o1)C(N)=N
Show InChI InChI=1S/C17H16N6O/c18-15(19)9-3-1-8(2-4-9)13-7-10-5-11(16(20)21)6-12(17(22)23)14(10)24-13/h1-7H,(H3,18,19)(H3,20,21)(H3,22,23)
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 1.23E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009965
PNG
(CHEMBL297809)
Show SMILES NC(=N)c1ccc2[nH]c(CCCCCCc3nc4cc(ccc4[nH]3)C(N)=N)nc2c1
Show InChI InChI=1S/C22H26N8/c23-21(24)13-7-9-15-17(11-13)29-19(27-15)5-3-1-2-4-6-20-28-16-10-8-14(22(25)26)12-18(16)30-20/h7-12H,1-6H2,(H3,23,24)(H3,25,26)(H,27,29)(H,28,30)
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 1.35E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009967
PNG
(CHEMBL417907)
Show SMILES NC(=N)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C22H16N8/c23-19(24)13-5-7-15-17(9-13)29-21(27-15)11-1-2-12(4-3-11)22-28-16-8-6-14(20(25)26)10-18(16)30-22/h1-10H,(H3,23,24)(H3,25,26)/b21-11-,22-12-
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 1.53E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM16127
PNG
(2,2 -methanediylbis(1H-benzimidazole-6-carboximida...)
Show SMILES NC(=N)c1ccc2nc(Cc3nc4ccc(cc4[nH]3)C(N)=N)[nH]c2c1
Show InChI InChI=1S/C17H16N8/c18-16(19)8-1-3-10-12(5-8)24-14(22-10)7-15-23-11-4-2-9(17(20)21)6-13(11)25-15/h1-6H,7H2,(H3,18,19)(H3,20,21)(H,22,24)(H,23,25)
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 1.73E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009928
PNG
(CHEMBL3251190)
Show SMILES NC(=N)c1ccc(cc1)C1=Nc2cc(ccc2C1=[N+]=[N-])C(N)=N |t:10|
Show InChI InChI=1S/C16H13N7/c17-15(18)9-3-1-8(2-4-9)13-14(23-21)11-6-5-10(16(19)20)7-12(11)22-13/h1-7H,(H3,17,18)(H3,19,20)
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 1.76E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009970
PNG
(CHEMBL52393)
Show SMILES NC(=N)c1ccc2[nH]c(CCCCCCCCc3nc4cc(ccc4[nH]3)C(N)=N)nc2c1
Show InChI InChI=1S/C24H30N8/c25-23(26)15-9-11-17-19(13-15)31-21(29-17)7-5-3-1-2-4-6-8-22-30-18-12-10-16(24(27)28)14-20(18)32-22/h9-14H,1-8H2,(H3,25,26)(H3,27,28)(H,29,31)(H,30,32)
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 1.81E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009971
PNG
(CHEMBL3251186)
Show SMILES Cn1c(cc2ccc(cc12)C(N)=N)-c1ccc(cc1)C(N)=N
Show InChI InChI=1S/C17H17N5/c1-22-14(10-2-4-11(5-3-10)16(18)19)8-12-6-7-13(17(20)21)9-15(12)22/h2-9H,1H3,(H3,18,19)(H3,20,21)
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 1.89E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)		BDBM50009973
PNG
(CHEMBL3251192)
Show SMILES Cc1cc(Nc2ccc(cc2)-c2ccc(cc2)-c2cc3cc(ccc3o2)C(N)=N)nc(N)n1
Show InChI InChI=1S/C26H22N6O/c1-15-12-24(32-26(29)30-15)31-21-9-6-17(7-10-21)16-2-4-18(5-3-16)23-14-20-13-19(25(27)28)8-11-22(20)33-23/h2-14H,1H3,(H3,27,28)(H3,29,30,31,32)
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 2.25E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...

J Med Chem 21: 613-23 (1978)


BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
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