Compile Data Set for Download or QSAR

Found 148 hits with Last Name = 'prades' and Initial = 'r'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413584 ((2S,4R)—N-[(1S)-1-[[(1S)-3-benzamido-1-(hydro...) Show SMILES CCCCCC(=O)N1C[C@H](F)C[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C29H44FN5O6/c1-5-7-9-14-24(36)35-18-21(30)17-23(35)29(40)34(4)25(19(3)6-2)28(39)32-22(27(38)33-41)15-16-31-26(37)20-12-10-8-11-13-20/h8,10-13,19,21-23,25,41H,5-7,9,14-18H2,1-4H3,(H,31,37)(H,32,39)(H,33,38)/t19?,21-,22+,23+,25+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298372 ((S)-1-((S)-1-(4-(benzyloxy)-3-(trifluoromethyl)ben...) Show SMILES FC(F)(F)c1cc(ccc1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C25H22F5N3O3/c26-24(27)12-20(23(35)32-10-4-7-18(32)13-31)33(15-24)22(34)17-8-9-21(19(11-17)25(28,29)30)36-14-16-5-2-1-3-6-16/h1-3,5-6,8-9,11,18,20H,4,7,10,12,14-15H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298372 ((S)-1-((S)-1-(4-(benzyloxy)-3-(trifluoromethyl)ben...) Show SMILES FC(F)(F)c1cc(ccc1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C25H22F5N3O3/c26-24(27)12-20(23(35)32-10-4-7-18(32)13-31)33(15-24)22(34)17-8-9-21(19(11-17)25(28,29)30)36-14-16-5-2-1-3-6-16/h1-3,5-6,8-9,11,18,20H,4,7,10,12,14-15H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298373 ((S)-1-((S)-1-(4-(benzyloxy)-3-fluorobenzoyl)-4,4-d...) Show SMILES Fc1cc(ccc1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H22F3N3O3/c25-19-11-17(8-9-21(19)33-14-16-5-2-1-3-6-16)22(31)30-15-24(26,27)12-20(30)23(32)29-10-4-7-18(29)13-28/h1-3,5-6,8-9,11,18,20H,4,7,10,12,14-15H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298373 ((S)-1-((S)-1-(4-(benzyloxy)-3-fluorobenzoyl)-4,4-d...) Show SMILES Fc1cc(ccc1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H22F3N3O3/c25-19-11-17(8-9-21(19)33-14-16-5-2-1-3-6-16)22(31)30-15-24(26,27)12-20(30)23(32)29-10-4-7-18(29)13-28/h1-3,5-6,8-9,11,18,20H,4,7,10,12,14-15H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413584 ((2S,4R)—N-[(1S)-1-[[(1S)-3-benzamido-1-(hydro...) Show SMILES CCCCCC(=O)N1C[C@H](F)C[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C29H44FN5O6/c1-5-7-9-14-24(36)35-18-21(30)17-23(35)29(40)34(4)25(19(3)6-2)28(39)32-22(27(38)33-41)15-16-31-26(37)20-12-10-8-11-13-20/h8,10-13,19,21-23,25,41H,5-7,9,14-18H2,1-4H3,(H,31,37)(H,32,39)(H,33,38)/t19?,21-,22+,23+,25+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298357 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@@H](C)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C27H31N3O5/c1-18-12-22(27(32)29-11-7-10-21(29)15-28)30(16-18)26(31)20-13-23(33-2)25(24(14-20)34-3)35-17-19-8-5-4-6-9-19/h4-6,8-9,13-14,18,21-22H,7,10-12,16-17H2,1-3H3/t18-,21-,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13.1	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298357 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@@H](C)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C27H31N3O5/c1-18-12-22(27(32)29-11-7-10-21(29)15-28)30(16-18)26(31)20-13-23(33-2)25(24(14-20)34-3)35-17-19-8-5-4-6-9-19/h4-6,8-9,13-14,18,21-22H,7,10-12,16-17H2,1-3H3/t18-,21-,22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13.1	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413580 ((2 S)-1-[(2S)-2-[acetyl(methyl)amino]propanoyl]-N-...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N(C)C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C29H42F2N6O7/c1-7-16(2)24(36(6)29(43)23-9-8-12-37(23)28(42)17(3)35(5)18(4)38)27(41)33-22(26(40)34-44)10-11-32-25(39)19-13-20(30)15-21(31)14-19/h13-17,22-24,44H,7-12H2,1-6H3,(H,32,39)(H,33,41)(H,34,40)/t16?,17-,22-,23-,24-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413577 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CC(F)(F)CN1C(=O)CCCOc1ccccc1)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C33H41F4N5O7/c1-4-20(2)28(31(46)39-25(30(45)40-48)12-13-38-29(44)21-15-22(34)17-23(35)16-21)41(3)32(47)26-18-33(36,37)19-42(26)27(43)11-8-14-49-24-9-6-5-7-10-24/h5-7,9-10,15-17,20,25-26,28,48H,4,8,11-14,18-19H2,1-3H3,(H,38,44)(H,39,46)(H,40,45)/t20?,25-,26-,28-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413582 ((2S)-1-[(2S)-2-[[(2S)-2-[butanoyl(methyl)amino]-3-...) Show SMILES CCCC(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298355 ((S)-1-((2S)-1-(4-(benzyloxy)-3,5-dimethoxybenzoyl)...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H27F2N3O5/c1-34-21-11-18(12-22(35-2)23(21)36-15-17-7-4-3-5-8-17)24(32)31-16-26(27,28)13-20(31)25(33)30-10-6-9-19(30)14-29/h3-5,7-8,11-12,19-20H,6,9-10,13,15-16H2,1-2H3/t19-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	48.7	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298355 ((S)-1-((2S)-1-(4-(benzyloxy)-3,5-dimethoxybenzoyl)...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H27F2N3O5/c1-34-21-11-18(12-22(35-2)23(21)36-15-17-7-4-3-5-8-17)24(32)31-16-26(27,28)13-20(31)25(33)30-10-6-9-19(30)14-29/h3-5,7-8,11-12,19-20H,6,9-10,13,15-16H2,1-2H3/t19-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	48.7	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298352 ((S)-1-((2S,4R)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H28FN3O5/c1-33-22-11-18(12-23(34-2)24(22)35-16-17-7-4-3-5-8-17)25(31)30-15-19(27)13-21(30)26(32)29-10-6-9-20(29)14-28/h3-5,7-8,11-12,19-21H,6,9-10,13,15-16H2,1-2H3/t19-,20+,21+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	60.4	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298352 ((S)-1-((2S,4R)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H28FN3O5/c1-33-22-11-18(12-23(34-2)24(22)35-16-17-7-4-3-5-8-17)25(31)30-15-19(27)13-21(30)26(32)29-10-6-9-20(29)14-28/h3-5,7-8,11-12,19-21H,6,9-10,13,15-16H2,1-2H3/t19-,20+,21+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	60.4	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413571 ((2S)-1-butanoyl-N-[(1S)-1-[[(1S)-3-[(3,5-difluorob...) Show SMILES CCCC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C27H39F2N5O6/c1-5-8-22(35)34-12-7-9-21(34)27(39)33(4)23(16(3)6-2)26(38)31-20(25(37)32-40)10-11-30-24(36)17-13-18(28)15-19(29)14-17/h13-16,20-21,23,40H,5-12H2,1-4H3,(H,30,36)(H,31,38)(H,32,37)/t16?,20-,21-,23-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298345 ((S)-1-((2S,4R)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)c1cc(OC)c(OCc2ccccc2)c(OC)c1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C27H31N3O6/c1-33-21-14-22(27(32)29-11-7-10-20(29)15-28)30(16-21)26(31)19-12-23(34-2)25(24(13-19)35-3)36-17-18-8-5-4-6-9-18/h4-6,8-9,12-13,20-22H,7,10-11,14,16-17H2,1-3H3/t20-,21+,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	63.8	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298345 ((S)-1-((2S,4R)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)c1cc(OC)c(OCc2ccccc2)c(OC)c1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C27H31N3O6/c1-33-21-14-22(27(32)29-11-7-10-20(29)15-28)30(16-21)26(31)19-12-23(34-2)25(24(13-19)35-3)36-17-18-8-5-4-6-9-18/h4-6,8-9,12-13,20-22H,7,10-11,14,16-17H2,1-3H3/t20-,21+,22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	63.8	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413579 ((2 S)-1-[(2S)-2-[acetyl(methyl)amino]-3-phenyl-pro...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C35H46F2N6O7/c1-6-21(2)30(33(47)39-27(32(46)40-50)14-15-38-31(45)24-18-25(36)20-26(37)19-24)42(5)34(48)28-13-10-16-43(28)35(49)29(41(4)22(3)44)17-23-11-8-7-9-12-23/h7-9,11-12,18-21,27-30,50H,6,10,13-17H2,1-5H3,(H,38,45)(H,39,47)(H,40,46)/t21?,27-,28-,29-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413570 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCCCCC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C29H43F2N5O6/c1-5-7-8-11-24(37)36-14-9-10-23(36)29(41)35(4)25(18(3)6-2)28(40)33-22(27(39)34-42)12-13-32-26(38)19-15-20(30)17-21(31)16-19/h15-18,22-23,25,42H,5-14H2,1-4H3,(H,32,38)(H,33,40)(H,34,39)/t18?,22-,23-,25-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298363 ((S)-1-((2S)-1-(4-benzoyloxy-3,5-dimethoxybenzoyl)-...) Show SMILES COc1cc(cc(OC)c1OC(=O)c1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H25F2N3O6/c1-35-20-11-17(12-21(36-2)22(20)37-25(34)16-7-4-3-5-8-16)23(32)31-15-26(27,28)13-19(31)24(33)30-10-6-9-18(30)14-29/h3-5,7-8,11-12,18-19H,6,9-10,13,15H2,1-2H3/t18-,19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298363 ((S)-1-((2S)-1-(4-benzoyloxy-3,5-dimethoxybenzoyl)-...) Show SMILES COc1cc(cc(OC)c1OC(=O)c1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C26H25F2N3O6/c1-35-20-11-17(12-21(36-2)22(20)37-25(34)16-7-4-3-5-8-16)23(32)31-15-26(27,28)13-19(31)24(33)30-10-6-9-18(30)14-29/h3-5,7-8,11-12,18-19H,6,9-10,13,15H2,1-2H3/t18-,19-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413582 ((2S)-1-[(2S)-2-[[(2S)-2-[butanoyl(methyl)amino]-3-...) Show SMILES CCCC(=O)N(C)[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	116	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413572 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)CC(C)C)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C28H41F2N5O6/c1-6-17(4)24(34(5)28(40)22-8-7-11-35(22)23(36)12-16(2)3)27(39)32-21(26(38)33-41)9-10-31-25(37)18-13-19(29)15-20(30)14-18/h13-17,21-22,24,41H,6-12H2,1-5H3,(H,31,37)(H,32,39)(H,33,38)/t17?,21-,22-,24-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	116	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413580 ((2 S)-1-[(2S)-2-[acetyl(methyl)amino]propanoyl]-N-...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N(C)C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C29H42F2N6O7/c1-7-16(2)24(36(6)29(43)23-9-8-12-37(23)28(42)17(3)35(5)18(4)38)27(41)33-22(26(40)34-44)10-11-32-25(39)19-13-20(30)15-21(31)14-19/h13-17,22-24,44H,7-12H2,1-6H3,(H,32,39)(H,33,41)(H,34,40)/t16?,17-,22-,23-,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413574 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCCCCC(=O)N1CC(F)(F)C[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C29H41F4N5O6/c1-5-7-8-9-23(39)38-16-29(32,33)15-22(38)28(43)37(4)24(17(3)6-2)27(42)35-21(26(41)36-44)10-11-34-25(40)18-12-19(30)14-20(31)13-18/h12-14,17,21-22,24,44H,5-11,15-16H2,1-4H3,(H,34,40)(H,35,42)(H,36,41)/t17?,21-,22-,24-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	159	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413579 ((2 S)-1-[(2S)-2-[acetyl(methyl)amino]-3-phenyl-pro...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)N(C)C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C35H46F2N6O7/c1-6-21(2)30(33(47)39-27(32(46)40-50)14-15-38-31(45)24-18-25(36)20-26(37)19-24)42(5)34(48)28-13-10-16-43(28)35(49)29(41(4)22(3)44)17-23-11-8-7-9-12-23/h7-9,11-12,18-21,27-30,50H,6,10,13-17H2,1-5H3,(H,38,45)(H,39,47)(H,40,46)/t21?,27-,28-,29-,30-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	174	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298359 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)C(F)(F)F |r| Show InChI InChI=1S/C27H28F3N3O5/c1-36-22-11-18(12-23(37-2)24(22)38-16-17-7-4-3-5-8-17)25(34)33-15-19(27(28,29)30)13-21(33)26(35)32-10-6-9-20(32)14-31/h3-5,7-8,11-12,19-21H,6,9-10,13,15-16H2,1-2H3/t19-,20-,21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298356 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)SC |r| Show InChI InChI=1S/C27H31N3O5S/c1-33-23-12-19(13-24(34-2)25(23)35-17-18-8-5-4-6-9-18)26(31)30-16-21(36-3)14-22(30)27(32)29-11-7-10-20(29)15-28/h4-6,8-9,12-13,20-22H,7,10-11,14,16-17H2,1-3H3/t20-,21-,22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298359 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)C(F)(F)F |r| Show InChI InChI=1S/C27H28F3N3O5/c1-36-22-11-18(12-23(37-2)24(22)38-16-17-7-4-3-5-8-17)25(34)33-15-19(27(28,29)30)13-21(33)26(35)32-10-6-9-20(32)14-31/h3-5,7-8,11-12,19-21H,6,9-10,13,15-16H2,1-2H3/t19-,20-,21-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298356 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)SC |r| Show InChI InChI=1S/C27H31N3O5S/c1-33-23-12-19(13-24(34-2)25(23)35-17-18-8-5-4-6-9-18)26(31)30-16-21(36-3)14-22(30)27(32)29-11-7-10-20(29)15-28/h4-6,8-9,12-13,20-22H,7,10-11,14,16-17H2,1-3H3/t20-,21-,22-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413568 ((2S)-1-acetyl-N-[(1S)-1-[[(1S)-3-[(4-fluorobenzoyl...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CCNC(=O)c1ccc(F)cc1)C(=O)NO |r| Show InChI InChI=1S/C25H36FN5O6/c1-5-15(2)21(30(4)25(36)20-7-6-14-31(20)16(3)32)24(35)28-19(23(34)29-37)12-13-27-22(33)17-8-10-18(26)11-9-17/h8-11,15,19-21,37H,5-7,12-14H2,1-4H3,(H,27,33)(H,28,35)(H,29,34)/t15?,19-,20-,21-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	202	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413577 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CC(F)(F)CN1C(=O)CCCOc1ccccc1)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C33H41F4N5O7/c1-4-20(2)28(31(46)39-25(30(45)40-48)12-13-38-29(44)21-15-22(34)17-23(35)16-21)41(3)32(47)26-18-33(36,37)19-42(26)27(43)11-8-14-49-24-9-6-5-7-10-24/h5-7,9-10,15-17,20,25-26,28,48H,4,8,11-14,18-19H2,1-3H3,(H,38,44)(H,39,46)(H,40,45)/t20?,25-,26-,28-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	223	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413571 ((2S)-1-butanoyl-N-[(1S)-1-[[(1S)-3-[(3,5-difluorob...) Show SMILES CCCC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C27H39F2N5O6/c1-5-8-22(35)34-12-7-9-21(34)27(39)33(4)23(16(3)6-2)26(38)31-20(25(37)32-40)10-11-30-24(36)17-13-18(28)15-19(29)14-17/h13-16,20-21,23,40H,5-12H2,1-4H3,(H,30,36)(H,31,38)(H,32,37)/t16?,20-,21-,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	235	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413569 ((2S)-1-acetyl-N-[(1S)-1-[[(1S)-3-[(3,5-difluoroben...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C25H35F2N5O6/c1-5-14(2)21(31(4)25(37)20-7-6-10-32(20)15(3)33)24(36)29-19(23(35)30-38)8-9-28-22(34)16-11-17(26)13-18(27)12-16/h11-14,19-21,38H,5-10H2,1-4H3,(H,28,34)(H,29,36)(H,30,35)/t14?,19-,20-,21-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	242	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298371 ((S)-1-((S)-1-(2-(benzyloxy)benzoyl)-4,4-difluoropy...) Show SMILES FC1(F)C[C@H](N(C1)C(=O)c1ccccc1OCc1ccccc1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H23F2N3O3/c25-24(26)13-20(23(31)28-12-6-9-18(28)14-27)29(16-24)22(30)19-10-4-5-11-21(19)32-15-17-7-2-1-3-8-17/h1-5,7-8,10-11,18,20H,6,9,12-13,15-16H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	255	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298371 ((S)-1-((S)-1-(2-(benzyloxy)benzoyl)-4,4-difluoropy...) Show SMILES FC1(F)C[C@H](N(C1)C(=O)c1ccccc1OCc1ccccc1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H23F2N3O3/c25-24(26)13-20(23(31)28-12-6-9-18(28)14-27)29(16-24)22(30)19-10-4-5-11-21(19)32-15-17-7-2-1-3-8-17/h1-5,7-8,10-11,18,20H,6,9,12-13,15-16H2/t18-,20-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	255	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413575 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCCC(CCC)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C31H47F2N5O6/c1-6-10-20(11-7-2)30(42)38-15-9-12-25(38)31(43)37(5)26(19(4)8-3)29(41)35-24(28(40)36-44)13-14-34-27(39)21-16-22(32)18-23(33)17-21/h16-20,24-26,44H,6-15H2,1-5H3,(H,34,39)(H,35,41)(H,36,40)/t19?,24-,25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413583 ((2S)—N-[(1S)-1-[[(1S)-3-benzamido-1-(hydroxyc...) Show SMILES CCCCCC(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)CC)C(=O)N[C@@H](CCNC(=O)c1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C29H45N5O6/c1-5-7-9-16-24(35)34-19-12-15-23(34)29(39)33(4)25(20(3)6-2)28(38)31-22(27(37)32-40)17-18-30-26(36)21-13-10-8-11-14-21/h8,10-11,13-14,20,22-23,25,40H,5-7,9,12,15-19H2,1-4H3,(H,30,36)(H,31,38)(H,32,37)/t20?,22-,23-,25-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	285	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298368 ((S)-1-((S)-1-(4-(benzyloxy)benzoyl)-4,4-difluoropy...) Show SMILES FC1(F)C[C@H](N(C1)C(=O)c1ccc(OCc2ccccc2)cc1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H23F2N3O3/c25-24(26)13-21(23(31)28-12-4-7-19(28)14-27)29(16-24)22(30)18-8-10-20(11-9-18)32-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,19,21H,4,7,12-13,15-16H2/t19-,21-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	287	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298368 ((S)-1-((S)-1-(4-(benzyloxy)benzoyl)-4,4-difluoropy...) Show SMILES FC1(F)C[C@H](N(C1)C(=O)c1ccc(OCc2ccccc2)cc1)C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C24H23F2N3O3/c25-24(26)13-21(23(31)28-12-4-7-19(28)14-27)29(16-24)22(30)18-8-10-20(11-9-18)32-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,19,21H,4,7,12-13,15-16H2/t19-,21-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	287	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413569 ((2S)-1-acetyl-N-[(1S)-1-[[(1S)-3-[(3,5-difluoroben...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C25H35F2N5O6/c1-5-14(2)21(31(4)25(37)20-7-6-10-32(20)15(3)33)24(36)29-19(23(35)30-38)8-9-28-22(34)16-11-17(26)13-18(27)12-16/h11-14,19-21,38H,5-10H2,1-4H3,(H,28,34)(H,29,36)(H,30,35)/t14?,19-,20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	301	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298364 ((S)-1-((2S)-1-(3,4-dibenzyloxy-5-methoxybenzoyl)-4...) Show SMILES COc1cc(cc(OCc2ccccc2)c1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCCC1C#N |r| Show InChI InChI=1S/C32H31F2N3O5/c1-40-27-15-24(30(38)37-21-32(33,34)17-26(37)31(39)36-14-8-13-25(36)18-35)16-28(41-19-22-9-4-2-5-10-22)29(27)42-20-23-11-6-3-7-12-23/h2-7,9-12,15-16,25-26H,8,13-14,17,19-21H2,1H3/t25?,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	336	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM435747 ((S)-1-((2S)-1-(3,4-dibenzyloxy-5-methoxybenzoyl)-4...) Show SMILES COc1cc(cc(OCc2ccccc2)c1OCc1ccccc1)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C32H31F2N3O5/c1-40-27-15-24(30(38)37-21-32(33,34)17-26(37)31(39)36-14-8-13-25(36)18-35)16-28(41-19-22-9-4-2-5-10-22)29(27)42-20-23-11-6-3-7-12-23/h2-7,9-12,15-16,25-26H,8,13-14,17,19-21H2,1H3/t25-,26-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	336	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM413581 ((2S)-1-[3-[acetyl(methyl)amino]propanoyl]-N-[(1S)-...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)CCN(C)C(C)=O)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C29H42F2N6O7/c1-6-17(2)25(36(5)29(43)23-8-7-12-37(23)24(39)10-13-35(4)18(3)38)28(42)33-22(27(41)34-44)9-11-32-26(40)19-14-20(30)16-21(31)15-19/h14-17,22-23,25,44H,6-13H2,1-5H3,(H,32,40)(H,33,42)(H,34,41)/t17?,22-,23-,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	339	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-9: Recombinant MMP-9 expressed was obtained from Merck-Millipore (catalog number PF140-5UG, used in examples 1 to 9 and comparative examples) and...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298353 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)c1ccccc1 |r| Show InChI InChI=1S/C32H33N3O5/c1-38-28-17-24(18-29(39-2)30(28)40-21-22-10-5-3-6-11-22)31(36)35-20-25(23-12-7-4-8-13-23)16-27(35)32(37)34-15-9-14-26(34)19-33/h3-8,10-13,17-18,25-27H,9,14-16,20-21H2,1-2H3/t25-,26+,27+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	339	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298353 ((S)-1-((2S,4S)-1-(4-(benzyloxy)-3,5-dimethoxybenzo...) Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)N1C[C@@H](C[C@H]1C(=O)N1CCC[C@H]1C#N)c1ccccc1 |r| Show InChI InChI=1S/C32H33N3O5/c1-38-28-17-24(18-29(39-2)30(28)40-21-22-10-5-3-6-11-22)31(36)35-20-25(23-12-7-4-8-13-23)16-27(35)32(37)34-15-9-14-26(34)19-33/h3-8,10-13,17-18,25-27H,9,14-16,20-21H2,1-2H3/t25-,26+,27+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	339	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Prolyl endopeptidase-like (Human)	BDBM298361 ((S)-1-((2S)-1-(4-acetoxy-3,5-dimethoxybenzoyl)-4,4...) Show SMILES COc1cc(cc(OC)c1OC(C)=O)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C21H23F2N3O6/c1-12(27)32-18-16(30-2)7-13(8-17(18)31-3)19(28)26-11-21(22,23)9-15(26)20(29)25-6-4-5-14(25)10-24/h7-8,14-15H,4-6,9,11H2,1-3H3/t14-,15-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	352	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNACIÓ INSTITUT DE RECERCA BIOMÉDICA; IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10611727 (2020) BindingDB Entry DOI: 10.7270/Q2377CQK
					More data for this Ligand-Target Pair
Prolyl endopeptidase (Homo sapiens (Human))	BDBM298361 ((S)-1-((2S)-1-(4-acetoxy-3,5-dimethoxybenzoyl)-4,4...) Show SMILES COc1cc(cc(OC)c1OC(C)=O)C(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C21H23F2N3O6/c1-12(27)32-18-16(30-2)7-13(8-17(18)31-3)19(28)26-11-21(22,23)9-15(26)20(29)25-6-4-5-14(25)10-24/h7-8,14-15H,4-6,9,11H2,1-3H3/t14-,15-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	352	n/a	n/a	n/a	n/a	n/a	n/a
UNIVERSITAT DE BARCELONA; FUNDACIO INSTITUT DE RECERCA BIOMEDICA (IRB BARCELONA); IPROTEOS S.L. US Patent					Assay Description POP activity was determined following the method described by Toide et al (Toide K et al., J. Pharmacol. Exp. Ther. 1995; 274:1370-8), using Z-G-P-AM...				US Patent US10125097 (2018) BindingDB Entry DOI: 10.7270/Q22J6DX3
					More data for this Ligand-Target Pair
Metalloproteinase inhibitor 2 (Cricetulus longicaudatus (Long-tailed dwarf hamste...)	BDBM413576 ((2S)—N-[(1S)-1-[[(1S)-3-[(3,5-difluorobenzoyl...) Show SMILES CCC(C)[C@H](N(C)C(=O)[C@@H]1CCCN1C(=O)CCCOc1ccccc1)C(=O)N[C@@H](CCNC(=O)c1cc(F)cc(F)c1)C(=O)NO |r| Show InChI InChI=1S/C33H43F2N5O7/c1-4-21(2)29(32(44)37-26(31(43)38-46)14-15-36-30(42)22-18-23(34)20-24(35)19-22)39(3)33(45)27-12-8-16-40(27)28(41)13-9-17-47-25-10-6-5-7-11-25/h5-7,10-11,18-21,26-27,29,46H,4,8-9,12-17H2,1-3H3,(H,36,42)(H,37,44)(H,38,43)/t21?,26-,27-,29-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	362	n/a	n/a	n/a	n/a	n/a	n/a
Iproteos S.L US Patent					Assay Description MMP-2: Recombinant MMP-2 expressed in Chinese hamster ovary (CHO) cells was obtained from Merck-Millipore (catalog number PF023-5UG). DQ gelatin from...				US Patent US10414797 (2019) BindingDB Entry DOI: 10.7270/Q2KS6TWP
					More data for this Ligand-Target Pair

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