TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T40332 Neutrophil elastase D0V3YT BOCEPREVIR Approved 10324367 C27H45N5O5 519.7 CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)NC(C)(C)C)C(=O)NC(CC3CCC3)C(=O)C(=O)N)C IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase D0A5BT Camostat mesylate Phase 2/3 5284360 C21H26N4O8S 494.5 CN(C)C(=O)COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N.CS(=O)(=O)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B01IJQ [(S)-1-((2S,3S)-2-Tert-Butoxy-4-oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 18395047 C24H29N3O5 439.5 CC(C)(C)O[C@H]1[C@@H](C(=O)N1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B0EV4J 2-Oxo-4-phenacylsulfanyl-N-[(1R)-1-phenylethyl]azetidine-1-carboxamide Investigative 482288 C20H20N2O3S 368.5 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC(=O)C3=CC=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B0FT8Z (3S,4S)-1,4-Diacetyl-3-methoxy-azetidin-2-one Investigative 44319384 C8H11NO4 185.18 CC(=O)[C@@H]1[C@@H](C(=O)N1C(=O)C)OC IC50 = 94000 nM Poor binder T40332 Neutrophil elastase B0FUD5 2-({5-[(1,3-Benzothiazol-2-ylsulfanyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetic acid Investigative 2372853 C18H14N4O2S3 414.5 C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)CSC3=NC4=CC=CC=C4S3 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B0UV3N (4S)-4-Methoxy-6,6-dioxo-10-oxa-6lambda6-thia-2-azatricyclo[6.3.0.02,5]undec-1(8)-ene-3,11-dione Investigative 14760380 C9H9NO6S 259.24 CO[C@@H]1C2N(C1=O)C3=C(COC3=O)CS2(=O)=O IC50 = 57800 nM Poor binder T40332 Neutrophil elastase B0XEY2 Met-Phe-Leu-Glu-Ala-Ile-Pro-Met-Ser Investigative 44273766 C47H75N9O13S2 1038.3 CC[C@@H](C)[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](CCSC)N Ki = 190000 nM Poor binder T40332 Neutrophil elastase B0Z8AI N-((1S)-2-Hydroxy-1-phenylethyl)[2-oxo-4-(2-pyridylmethylthio)azetidinyl]carboxamide Investigative 482292 C18H19N3O3S 357.4 C1C(N(C1=O)C(=O)N[C@H](CO)C2=CC=CC=C2)SCC3=CC=CC=N3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B1SPU6 (4R)-4-[[(2S)-2-Acetamido-3-carboxypropanoyl]amino]-5-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-oxo-1-[(2S,4R)-2-[[pentyl-[[(1S)-1-phenylethyl]carbamoyl]amino]carbamoyl]-4-phenylmethoxypyrrolidin-1-yl]butan-2-yl]amino]-1-oxopentan-2-yl]amino]-5-oxopentanoic acid Investigative 644155 C48H70N8O12 951.1 CCCCCN(C(=O)N[C@@H](C)C1=CC=CC=C1)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)C)OCC3=CC=CC=C3 IC50 = 151000 nM Poor binder T40332 Neutrophil elastase B1TMI4 (S)-2-Benzyl-4-oxo-azetidine-1-carboxylic acid (pyridin-4-ylmethyl)-amide Investigative 10756289 C17H17N3O2 295.34 C1[C@@H](N(C1=O)C(=O)NCC2=CC=NC=C2)CC3=CC=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B23VKE 2-(4-Fluoroanilino)-5H-[1,3]thiazino[5,4-b]indol-4-one Investigative 44317285 C16H10FN3OS 311.3 C1=CC=C2C(=C1)C3=C(N2)C(=O)SC(=N3)NC4=CC=C(C=C4)F Ki ~ 104000 nM Poor binder T40332 Neutrophil elastase B23YKO 2-[5-(2-Methyl-furan-3-yl)-4-(1-phenyl-ethyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-phenethyl-acetamide Investigative 644930 C25H26N4O2S 446.6 CC1=C(C=CO1)C2=NN=C(N2C(C)C3=CC=CC=C3)SCC(=O)NCCC4=CC=CC=C4 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B26TUB [(S)-1-((3R,4S)-2-Oxo-4-phenylsulfanyl-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 10457653 C26H25N3O4S 475.6 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@@H](NC2=O)SC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B29LPH 2-(2,3,4,5,6-Pentafluorophenyl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide Investigative 44561932 C13H8F5NO3S 353.27 C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=C(C(=C(C(=C3F)F)F)F)F IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B2GAY6 Tert-butyl (2E)-2-[(5S,6R)-6-[(1R)-1-hydroxyethyl]-7-oxo-2,4-dithia-1-azabicyclo[3.2.0]heptan-3-ylidene]acetate Investigative 44312600 C12H17NO4S2 303.4 C[C@H]([C@H]1[C@H]2N(C1=O)S/C(=C/C(=O)OC(C)(C)C)/S2)O Ki ~ 100000 nM Poor binder T40332 Neutrophil elastase B2K3UI 3-[(3-Acetoxymethyl-7-methoxy-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carbonyl)-amino]-propionic acid Investigative 14760306 C14H18N2O9S 390.37 CC(=O)OCC1=C(N2[C@@H]([C@H](C2=O)OC)S(=O)(=O)C1)C(=O)NCCC(=O)O IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B2MZQ5 [(3-Acetoxymethyl-7-methoxy-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carbonyl)-amino]-acetic acid Investigative 14760308 C13H16N2O9S 376.34 CC(=O)OCC1=C(N2[C@@H]([C@H](C2=O)OC)S(=O)(=O)C1)C(=O)NCC(=O)O IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B2OHL3 3-[(1-{2-[(1-Acetyl-pyrrolidine-2-carbonyl)-amino]-propionyl}-pyrrolidine-2-carbonyl)-amino]-2-oxo-butyric acid Investigative 44353364 C19H28N4O7 424.4 C[C@@H](C(=O)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)C Ki = 66000 nM Poor binder T40332 Neutrophil elastase B2RNQ7 2-[4-(4-Methoxyphenyl)-5-(2-naphthyloxymethyl)-1,2,4-triazol-3-ylthio]acetic a cid Investigative 1169805 C22H19N3O4S 421.5 COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)COC3=CC4=CC=CC=C4C=C3 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B30API (2S)-N-[(1S)-3-Methyl-1-({4-oxo-1-[N-benzylcarbamoyl]azetidin-2-yloxy}methyl)butyl]-2-[(tert-butoxy)carbonylamino]-3,3-dimethylbutanamide Investigative 482277 C28H44N4O6 532.7 CC(C)C[C@@H](COC1CC(=O)N1C(=O)NCC2=CC=CC=C2)NC(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B30PIA Tomentin D Investigative 71659766 C27H34O8 486.6 CC1(CCC2=C(C3=C(C=C2O1)O[C@@H](CC3=O)C4=CC(=C(C(=C4)OC)O)OC)O)CCCC(C)(C)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B32RZV [4-[[2-[(E)-N-(3-Hydroxypropoxy)-C-methylcarbonimidoyl]phenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate Investigative 118010070 C22H28N2O6S 448.5 C/C(=N\\OCCCO)/C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OC(=O)C(C)(C)C IC50 = 158800 nM Poor binder T40332 Neutrophil elastase B35VJP E-6-O-p-Feruloyl scandoside methyl ester Investigative 46225505 C27H32O14 580.5 COC1=C(C=CC(=C1)/C=C/C(=O)O[C@@H]2C=C([C@@H]3[C@H]2C(=CO[C@H]3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C(=O)OC)CO)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B36ZIR 2-(6-Bromopyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide Investigative 44561892 C12H11BrN2O3S 343.2 C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=NC(=CC=C3)Br IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B3KHJ2 3-Acetoxymethyl-7-methoxy-5,5,8-trioxo-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid Investigative 10087296 C11H13NO8S 319.29 CC(=O)OCC1=C(N2[C@@H]([C@H](C2=O)OC)S(=O)(=O)C1)C(=O)O IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B3KYM0 4,5-Dimethyl-2-(2,3,5,6-tetrafluoropyridin-4-yl)-isothiazol-3(2H)-one 1,1-dioxide Investigative 44561930 C10H6F4N2O3S 310.23 CC1=C(S(=O)(=O)N(C1=O)C2=C(C(=NC(=C2F)F)F)F)C IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B47CTI (3As,6R)-6-Allyl-4-(naphthalene-1-sulfonyl)-5-oxo-hexahydro-pyrrolo[3,2-b]pyrrole-1-carboxylic acid benzyl ester Investigative 44351162 C27H26N2O5S 490.6 C=CC[C@@H]1C2[C@H](CCN2C(=O)OCC3=CC=CC=C3)N(C1=O)S(=O)(=O)C4=CC=CC5=CC=CC=C54 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B4A0SE 4-(2-{2-[2-(4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-4,4-difluoro-butyrylamino}-ethyl)-3-chloro-benzoic acid Investigative 44343906 C29H41ClF2N4O9 663.1 CC(C)C[C@@H](C(=O)NC(CC(F)F)C(=O)NCCC1=C(C=C(C=C1)C(=O)O)Cl)NC(=O)C(CCC(=O)O)NC(=O)OCC(C)C Ki ~ 100000 nM Poor binder T40332 Neutrophil elastase B4DRN9 Chembl4175745 Investigative 86268083 C25H30O6 426.5 C/C(=C\\CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC=C(C=C3)O)O)/CCCC(C)(C)O IC50 = 74700 nM Poor binder T40332 Neutrophil elastase B4GB9S ((S)-1-{(S)-2-[(S)-1-(3-Ethoxy-pyridine-2-carbonyl)-2-methyl-propylcarbamoyl]-pyrrolidine-1-carbonyl}-2-methyl-propyl)-carbamic acid benzyl ester Investigative 10076315 C30H40N4O6 552.7 CCOC1=C(N=CC=C1)C(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3 Ki = 87000 nM Poor binder T40332 Neutrophil elastase B4M8LQ 4-{5-[(Z)-(5-Cyano-2-hydroxy-4-methyl-6-oxopyridin-3(6H)-ylidene)methyl]furan-2-yl}benzenesulfonamide Investigative 2264784 C18H13N3O5S 383.4 CC\\1=C(C(=O)NC(=O)/C1=C\\C2=CC=C(O2)C3=CC=C(C=C3)S(=O)(=O)N)C#N IC50 = 52200 nM Poor binder T40332 Neutrophil elastase B5DS1I (5-Hydroxy-4-oxo-4h-pyran-2-yl)methyl hexadecanoate Investigative 223062 C22H36O5 380.5 CCCCCCCCCCCCCCCC(=O)OCC1=CC(=O)C(=CO1)O IC50 = 100000 nM Poor binder T40332 Neutrophil elastase B5QXT8 4-((R)-1-((R)-6-(5-Chloro-2-methoxybenzyl)-2,5-dioxo-1,4-diazepane-4-carboxamido)propyl)-2-aminobenzoic acid Investigative 11540629 C24H27ClN4O6 502.9 CC[C@H](C1=CC(=C(C=C1)C(=O)O)N)NC(=O)N2CC(=O)NC[C@H](C2=O)CC3=C(C=CC(=C3)Cl)OC IC50 = 100000 nM Poor binder T40332 Neutrophil elastase B6IC7R [(S)-1-((2S,3S)-2-Isobutoxy-4-oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 18395048 C24H29N3O5 439.5 CC(C)CO[C@H]1[C@@H](C(=O)N1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B6JPV8 N-((1R)-1-Phenylethyl)[2-oxo-4-(2-pyridylmethylthio)azetidinyl]carboxamide Investigative 482287 C18H19N3O2S 341.4 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CC=CC=N3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B6L2WG Adamantane-1-carboxylic acid 6-octadec-9-enoyloxymethyl-4-oxo-4H-pyran-3-yl ester Investigative 14089184 C35H52O6 568.8 CCCCCCCC/C=C/CCCCCCCC(=O)OCC1=CC(=O)C(=CO1)OC(=O)C23CC4CC(C2)CC(C4)C3 IC50 = 80000 nM Poor binder T40332 Neutrophil elastase B6MN7T 2-Chloro-5-[(4Z)-4-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3,5-dioxopyrazolidin-1-yl]benzoic acid Investigative 44415189 C21H12Cl2N2O5 443.2 C1=CC(=CC=C1C2=CC=C(O2)/C=C\\3/C(=O)NN(C3=O)C4=CC(=C(C=C4)Cl)C(=O)O)Cl IC50 = 89800 nM Poor binder T40332 Neutrophil elastase B6NB3X (4-Carbamimidoylphenyl) 4-[(E)-3-[(2-ethoxy-2-oxoethyl)-prop-2-enylamino]-2-methyl-3-oxoprop-1-enyl]benzoate;methanesulfonic acid Investigative 6442224 C26H31N3O8S 545.6 CCOC(=O)CN(CC=C)C(=O)/C(=C/C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N)/C.CS(=O)(=O)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B6NP8K (9-Benzyl-2,4-dioxo-1H-[1,3]oxazino[4,5-b]indol-6-yl) acetate Investigative 10665528 C19H14N2O5 350.3 CC(=O)OC1=CC2=C(C=C1)N(C3=C2C(=O)OC(=O)N3)CC4=CC=CC=C4 IC50 = 75000 nM Poor binder T40332 Neutrophil elastase B6PSY3 4-(4-Guanidinobenzoyloxy)phenylacetic acid Investigative 130394 C17H19N3O7S 409.4 CS(=O)(=O)O.C1=CC(=CC=C1CC(=O)O)OC(=O)C2=CC=C(C=C2)N=C(N)N IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B6S2QZ 2-(4-Methylanilino)-5H-[1,3]thiazino[5,4-b]indol-4-one Investigative 44317274 C17H13N3OS 307.4 CC1=CC=C(C=C1)NC2=NC3=C(C(=O)S2)NC4=CC=CC=C43 Ki ~ 78000 nM Poor binder T40332 Neutrophil elastase B7AY1W [(S)-1-((3R,4R)-2-Oxo-4-phenylsulfanyl-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 44279475 C26H25N3O4S 475.6 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@H](NC2=O)SC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B7PJ2X 4-(1-{1-[2-(2-Chloro-phenyl)-ethylcarbamoyl]-2-mercapto-ethylcarbamoyl}-3-methyl-butylcarbamoyl)-4-isobutoxycarbonylamino-butyric acid Investigative 44343907 C28H41ClF2N4O7 619.1 CC(C)C[C@@H](C(=O)NC(CC(F)F)C(=O)NCCC1=CC=CC=C1Cl)NC(=O)C(CCC(=O)O)NC(=O)OC(C)(C)C Ki ~ 100000 nM Poor binder T40332 Neutrophil elastase B7PMG1 2-(6-Chloropyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide Investigative 44561891 C12H11ClN2O3S 298.75 C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=NC(=CC=C3)Cl IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B7QLA0 [(S)-1-((R)-2-Oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 44279873 C20H21N3O4 367.4 C1[C@H](C(=O)N1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase B7U1TP 4-(3,3-Diethyl-2,4-dioxoazetidin-1-yl)benzonitrile Investigative 24823609 C14H14N2O2 242.27 CCC1(C(=O)N(C1=O)C2=CC=C(C=C2)C#N)CC Ki = 63500 nM Poor binder T40332 Neutrophil elastase B7WK2D N-((1R)-1-Phenylpropyl)[2-oxo-4-(2-pyridylmethylthio)azetidinyl]carboxamide Investigative 482290 C19H21N3O2S 355.5 CC[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CC=CC=N3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase B7YB3K Benzyl 2-[[2-(1-aminopropyl)-1,3-oxazole-4-carbonyl]amino]-3-phenylpropanoate Investigative 3435549 C23H25N3O4 407.5 CCC(C1=NC(=CO1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)N IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B89CMZ {[(2S,5R,6R)-3,3-Dimethyl-4,4,7-trioxo-6-(2,2,2-trifluoro-acetylamino)-4lambda*6*-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl]-methyl-amino}-acetic acid Investigative 44313122 C13H16F3N3O7S 415.34 CC1([C@@H](N2[C@H](S1(=O)=O)[C@@H](C2=O)NC(=O)C(F)(F)F)C(=O)N(C)CC(=O)O)C Ki = 50000 nM Poor binder T40332 Neutrophil elastase B8PY5V (5Z)-5-[(2,4-Dihydroxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one Investigative 7028541 C10H8N2O3S 236.25 C1=CC(=C(C=C1O)O)/C=C\\2/C(=O)NC(=S)N2 IC50 = 84800 nM Poor binder T40332 Neutrophil elastase B8RS5T 1,1-Dioxo-2-pyridin-4-yl-4,5,6,7-tetrahydro-1,2-benzothiazol-3-one;perchloric acid Investigative 49797481 C12H13ClN2O7S 364.76 C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=CC=NC=C3.OCl(=O)(=O)=O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B8V7JZ N1-(3,4-Dimethoxyphenethyl)-2-phenyl-2-(2-pyridylthio)acetamide Investigative 433517 C23H24N2O3S 408.5 COC1=C(C=C(C=C1)CCNC(=O)C(C2=CC=CC=C2)SC3=CC=CC=N3)OC IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B8X1PH Methyl 2-{[2-(1H-1,3-benzimidazol-2-ylsulfanyl)acetyl]amino}-3-(benzylsulfanyl)propanoate Investigative 5294946 C20H21N3O3S2 415.5 COC(=O)C(CSCC1=CC=CC=C1)NC(=O)CSC2=NC3=CC=CC=C3N2 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase B9RI7L (2S)-2-Amino-N-[(1R,2R)-1-cyano-2-phenylcyclopropyl]-3-thiophen-2-ylpropanamide;2,2,2-trifluoroacetic acid Investigative 49797573 C19H18F3N3O3S 425.4 C1[C@@H]([C@]1(C#N)NC(=O)[C@H](CC2=CC=CS2)N)C3=CC=CC=C3.C(=O)(C(F)(F)F)O IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BA5VB4 (1R,2S)-1-[[(2S,4R)-1-[(2S)-2-(Tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carbonyl]amino]-2-vinyl-cyclopropanecarboxylic acid Investigative 5271294 C38H46N4O8 686.8 CC(C)(C)[C@@H](C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@]2(C[C@H]2C=C)C(=O)O)OC3=CC(=NC4=C3C=CC(=C4)OC)C5=CC=CC=C5)NC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BAQ8C7 2-[4-(4-Methoxyphenyl)-5-(2-naphthyloxymethyl)-1,2,4-triazol-3-ylthio]acetamid e Investigative 1169804 C22H20N4O3S 420.5 COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)COC3=CC4=CC=CC=C4C=C3 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BB3P4Z 4-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic acid Investigative 668744 C13H13NO3 231.25 CC1=CC=C(N1C2=CC(=C(C=C2)C(=O)O)O)C IC50 = 51500 nM Poor binder T40332 Neutrophil elastase BB7OU5 N-((1R)-1-Phenylethyl)(2-oxo-4-phenylthioazetidinyl)carboxamide Investigative 482282 C18H18N2O2S 326.4 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SC3=CC=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BC58XS 2-[(1R)-1-[[(6R)-6-[(5-Chloro-2-methoxyphenyl)methyl]-3,7-dioxo-1,4-diazepane-1-carbonyl]amino]propyl]-1,3-oxazole-4-carboxylic acid Investigative 71723878 C21H23ClN4O7 478.9 CC[C@H](C1=NC(=CO1)C(=O)O)NC(=O)N2CC(=O)NC[C@H](C2=O)CC3=C(C=CC(=C3)Cl)OC IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BC9L8Y Tert-butyl (2E)-2-[(5R,6S)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]heptan-3-ylidene]acetate Investigative 44312415 C14H21NO4 267.32 C[C@H]([C@@H]1[C@H]2C/C(=C\\C(=O)OC(C)(C)C)/CN2C1=O)O Ki ~ 100000 nM Poor binder T40332 Neutrophil elastase BC9M0N N-((1R)-1-Phenylethyl)[2-oxo-4-(3-pyridylmethylthio)azetidinyl]carboxamide Investigative 482286 C18H19N3O2S 341.4 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CN=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BCHY67 1-Methoxy-2-methylanthracene-9,10-dione Investigative 3534338 C16H12O3 252.26 CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)OC IC50 ~ 60000 nM Poor binder T40332 Neutrophil elastase BCMV20 Cambridge id 7076131 Investigative 1331170 C26H19N5O 417.5 C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CC=N4)C5=CC=CC=N5 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BD32BG 2-Chloro-5-(2,5-dimethyl-pyrrol-1-yl)-benzoic acid Investigative 776842 C13H12ClNO2 249.69 CC1=CC=C(N1C2=CC(=C(C=C2)Cl)C(=O)O)C IC50 = 160200 nM Poor binder T40332 Neutrophil elastase BDV09Q 2-(2-Fluoroanilino)-5H-[1,3]thiazino[5,4-b]indol-4-one Investigative 44317137 C16H10FN3OS 311.3 C1=CC=C2C(=C1)C3=C(N2)C(=O)SC(=N3)NC4=CC=CC=C4F Ki ~ 88000 nM Poor binder T40332 Neutrophil elastase BDW2U3 (3,4,5-Trimethoxy-phenyl)-(3,4,5-trimethyl-pyrazol-1-yl)-methanone Investigative 753830 C16H20N2O4 304.34 CC1=C(N(N=C1C)C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C Ki = 50900 nM Poor binder T40332 Neutrophil elastase BE6S4C Tert-butyl 2-[4-[[4-oxo-1-[[(1R)-1-phenylethyl]carbamoyl]azetidin-2-yl]sulfanylmethyl]phenyl]acetate Investigative 482289 C25H30N2O4S 454.6 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CC=C(C=C3)CC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BF7CZ9 4-(Morpholine-4-carbonyl)-N-{(R)-2-oxo-1-[(3,3,4,4,4-pentafluoro-1-isopropyl-2-oxo-butylcarbamoyl)-methyl]-piperidin-3-yl}-benzamide Investigative 44461781 C26H31F5N4O6 590.5 CC(C)C(C(=O)C(C(F)(F)F)(F)F)NC(=O)CN1CCC[C@H](C1=O)NC(=O)C2=CC=C(C=C2)C(=O)N3CCOCC3 Ki = 95000 nM Poor binder T40332 Neutrophil elastase BFC39R 6-O-Z-p-Methoxycinnamoyl scandoside methyl ester Investigative 44584781 C27H32O13 564.5 COC1=CC=C(C=C1)/C=C\\C(=O)O[C@@H]2C=C([C@@H]3[C@H]2C(=CO[C@H]3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)C(=O)OC)CO IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BFX29D 3-Phenyl-propionic acid (2S,3S)-3-((S)-2-benzyloxycarbonylamino-3-phenyl-propionylamino)-4-oxo-azetidin-2-yl ester Investigative 44280172 C29H29N3O6 515.6 C1=CC=C(C=C1)CCC(=O)O[C@H]2[C@@H](C(=O)N2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BG8V7H 4-((2R,3R)-1-Benzylcarbamoyl-3-methyl-4-oxo-3-propyl-azetidin-2-yloxy)-benzoic acid Investigative 10363347 C22H24N2O5 396.4 CCC[C@@]1([C@H](N(C1=O)C(=O)NCC2=CC=CC=C2)OC3=CC=C(C=C3)C(=O)O)C Ki = 51000 nM Poor binder T40332 Neutrophil elastase BH01QX [2,4-Dioxo-9-(2-phenylethyl)-1H-[1,3]oxazino[4,5-b]indol-6-yl] acetate Investigative 44385622 C20H16N2O5 364.4 CC(=O)OC1=CC2=C(C=C1)N(C3=C2C(=O)OC(=O)N3)CCC4=CC=CC=C4 IC50 = 92000 nM Poor binder T40332 Neutrophil elastase BH1A0P {(S)-1-[(S)-1-((R)-2-{(S)-1-[(S)-1-((S)-1-Isopropylcarbamoyl-ethylcarbamoyl)-ethylcarbamoyl]-2-methyl-propylcarbamoyl}-pyrrolidin-1-ylcarbamoyl)-ethylcarbamoyl]-ethyl}-carbamic acid benzyl ester Investigative 44363091 C33H52N8O8 688.8 C[C@@H](C(=O)NC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]1CCCN1NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)OCC2=CC=CC=C2 Ki = 65000 nM Poor binder T40332 Neutrophil elastase BH5SG9 [2-Oxo-4-(2-pyridylmethylthio)azetidinyl]-N-[2-(phenylmethoxy)ethyl]carboxamide Investigative 482291 C19H21N3O3S 371.5 C1C(N(C1=O)C(=O)NCCOCC2=CC=CC=C2)SCC3=CC=CC=N3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BH87CS Benzoic acid (2S,3S)-3-((S)-2-benzyloxycarbonylamino-3-phenyl-propionylamino)-4-oxo-azetidin-2-yl ester Investigative 44280152 C27H25N3O6 487.5 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@@H](NC2=O)OC(=O)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BI2C3Y {(S)-1-[(S)-1-(1-Benzylcarbamoyl-4-oxo-azetidin-2-ylsulfanylmethyl)-3-methyl-butylcarbamoyl]-2,2-dimethyl-propyl}-carbamic acid tert-butyl ester Investigative 482280 C28H44N4O5S 548.7 CC(C)C[C@@H](CSC1CC(=O)N1C(=O)NCC2=CC=CC=C2)NC(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BI7MJ1 6-(3,5-Difluoroanilino)-9-(2,2-difluoroethyl)purine-2-carbonitrile Investigative 44143089 C14H8F4N6 336.25 C1=C(C=C(C=C1F)F)NC2=C3C(=NC(=N2)C#N)N(C=N3)CC(F)F IC50 = 85113.8 nM Poor binder T40332 Neutrophil elastase BJ28MD [4-(2,5-Dimethyl-pyrrol-1-yl)-phenyl]-acetic acid Investigative 767161 C14H15NO2 229.27 CC1=CC=C(N1C2=CC=C(C=C2)CC(=O)O)C IC50 = 124900 nM Poor binder T40332 Neutrophil elastase BJ4XD5 N-[3-[(4-Fluorophenyl)methoxy]phenyl]-1-pyridin-4-ylpiperidine-4-carboxamide Investigative 72712049 C24H24FN3O2 405.5 C1CN(CCC1C(=O)NC2=CC(=CC=C2)OCC3=CC=C(C=C3)F)C4=CC=NC=C4 Ki = 68700 nM Poor binder T40332 Neutrophil elastase BJUQ13 2-(3-Fluoroanilino)-5H-[1,3]thiazino[5,4-b]indol-4-one Investigative 44317149 C16H10FN3OS 311.3 C1=CC=C2C(=C1)C3=C(N2)C(=O)SC(=N3)NC4=CC(=CC=C4)F Ki ~ 72000 nM Poor binder T40332 Neutrophil elastase BK30LT [4-[[2-[(E)-N-Hydroxy-C-methylcarbonimidoyl]phenyl]sulfamoyl]phenyl] 2,2-dimethylpropanoate Investigative 91820630 C19H22N2O5S 390.5 C/C(=N\\O)/C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OC(=O)C(C)(C)C IC50 = 51260 nM Poor binder T40332 Neutrophil elastase BK3E5C 2-[[4-(4-Methylphenyl)-5-(naphthalen-2-yloxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Investigative 90666510 C22H19N3O3S 405.5 CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)COC3=CC4=CC=CC=C4C=C3 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BK7W3E 2-Amino-4H-3,1-benzoxazin-4-one Investigative 9834041 C8H6N2O2 162.15 C1=CC=C2C(=C1)C(=O)OC(=N2)N Ki = 63000 nM Poor binder T40332 Neutrophil elastase BLI34B 2-[(2S)-2-[[(2S)-2-(3,3-Dimethylbutanoylamino)-3,3-dimethylbutanoyl]amino]-4-methylpentyl]sulfanyl-4-oxo-N-[(1S)-1-phenylpropyl]azetidine-1-carboxamide Investigative 44282051 C31H50N4O4S 574.8 CC[C@@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SC[C@H](CC(C)C)NC(=O)[C@H](C(C)(C)C)NC(=O)CC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BMX70R 2-[[(E)-3-[4-(4-Carbamimidoylphenoxy)carbonylphenyl]-2-methylprop-2-enoyl]-prop-2-enylamino]acetic acid;methanesulfonic acid Investigative 44318819 C24H27N3O8S 517.6 C/C(=C\\C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N)/C(=O)N(CC=C)CC(=O)O.CS(=O)(=O)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BN56LG 6-O-E-Pcoumaroyl scandoside methyl ester Investigative 44584784 C26H30O13 550.5 COC(=O)C1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2CO)OC(=O)/C=C/C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BNHQ54 cis-(S)-2-Amino-N-((1R,2R)-1-cyano-2-phenylcyclopropyl)-3-(thiophen-2-yl)propanamide Investigative 24822701 C17H17N3OS 311.4 C1[C@@H]([C@]1(C#N)NC(=O)[C@H](CC2=CC=CS2)N)C3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BOV2E3 ((S)-2,2-Dimethyl-1-{(S)-3-methyl-1-[4-oxo-1-((R)-1-phenyl-ethylcarbamoyl)-azetidin-2-yloxymethyl]-butylcarbamoyl}-propyl)-carbamic acid tert-butyl ester Investigative 482278 C29H46N4O6 546.7 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)OC[C@H](CC(C)C)NC(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BP9RC7 (3R,4S)-1-[(R)-[5-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-1,3-dioxolan-4-yl]-(1,3-dithian-2-yl)methyl]-3-methoxy-4-[(E)-2-phenylethenyl]azetidin-2-one Investigative 44319367 C27H37NO6S2 535.7 CC1(OCC(O1)C2C(OC(O2)(C)C)[C@H](C3SCCCS3)N4[C@H]([C@H](C4=O)OC)/C=C/C5=CC=CC=C5)C IC50 = 76000 nM Poor binder T40332 Neutrophil elastase BQB9A5 2-Oxo-4-phenethylsulfanyl-N-[(1R)-1-phenylethyl]azetidine-1-carboxamide Investigative 482284 C20H22N2O2S 354.5 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCCC3=CC=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BQKS72 (2S,3S)-N-[(2S)-1-[[2-(Butylamino)-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-3-methyl-2-[(2-phenylacetyl)amino]pentanamide Investigative 71462857 C26H42N4O4 474.6 CCCCNC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)CC1=CC=CC=C1 IC50 = 51000 nM Poor binder T40332 Neutrophil elastase BQR6Y0 CID 57671050 Investigative 57671050 C22H24ClN3O7 477.9 CC[C@H](C1=CC(=CO1)C(=O)O)NC(=O)N2CC(=O)NC[C@H](C2=O)CC3=C(C=CC(=C3)Cl)OC IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BQTL23 12-Phenyl-2-[({[(E)-phenylmethylidene]amino}oxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol Investigative 9636571 C26H19N5O3 449.5 C1=CC=C(C=C1)/C=N/OCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)C=C(C=C5)O)C6=CC=CC=C6 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BQY91R 2-Butyl-2-(3,5-dibutyl-4-hydroxy-6-oxopyran-2-yl)octanal Investigative 54732424 C25H42O4 406.6 CCCCCCC(CCCC)(C=O)C1=C(C(=C(C(=O)O1)CCCC)O)CCCC Ki = 151356.12 nM Poor binder T40332 Neutrophil elastase BR2U9I [((2S,5R,6S)-6-Methoxy-3,3-dimethyl-4,4,7-trioxo-4lambda*6*-thia-1-aza-bicyclo[3.2.0]heptane-2-carbonyl)-methyl-amino]-acetic acid Investigative 44313131 C12H18N2O7S 334.35 CC1([C@@H](N2[C@H](S1(=O)=O)[C@H](C2=O)OC)C(=O)N(C)CC(=O)O)C Ki = 53000 nM Poor binder T40332 Neutrophil elastase BR8C5L (R)-3-((S)-2-Acetylamino-3-carboxy-propionylamino)-N-((1S,2S)-1-{(S)-1-[2-((R)-1-benzylcarbamoyl-butylcarbamoyl)-pyrrolidine-1-carbonyl]-2-methyl-propylcarbamoyl}-2-methyl-butyl)-succinamic acid Investigative 73353012 C38H57N7O11 787.9 CCC[C@H](C(=O)NCC1=CC=CC=C1)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)C IC50 = 120000 nM Poor binder T40332 Neutrophil elastase BRT8S9 ((S)-2,2-Dimethyl-1-{(S)-3-methyl-1-[4-oxo-1-((S)-1-phenyl-ethylcarbamoyl)-azetidin-2-yloxymethyl]-butylcarbamoyl}-propyl)-carbamic acid tert-butyl ester Investigative 482279 C29H46N4O6 546.7 C[C@@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)OC[C@H](CC(C)C)NC(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BSV7X4 [(S)-1-((2S,3S)-2-Butoxy-4-oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 44279823 C24H29N3O5 439.5 CCCCO[C@H]1[C@@H](C(=O)N1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BT01HE C19H17N5OS3 Investigative 1993219 C19H17N5OS3 427.6 C1CC2=C(C1)SC3=C2C4=NN=C(N4C(=N3)SCC5=CC=CC=C5)SCC(=O)N IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BU83LA 4'-O-Methyldiplacone Investigative 24854122 C26H30O6 438.5 CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC(=C(C=C3)OC)O)O)/C)C IC50 = 59100 nM Poor binder T40332 Neutrophil elastase BUW9V4 [(S)-1-((2S,3R)-2-Benzenesulfonyl-4-oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 10346121 C26H25N3O6S 507.6 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@@H](NC2=O)S(=O)(=O)C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BUZ5I7 ((S)-2-Methyl-1-{(S)-2-[(S)-2-methyl-1-(1-methyl-1H-imidazole-2-carbonyl)-propylcarbamoyl]-pyrrolidine-1-carbonyl}-propyl)-carbamic acid benzyl ester Investigative 10052095 C27H37N5O5 511.6 CC(C)[C@@H](C(=O)C1=NC=CN1C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3 Ki = 80000 nM Poor binder T40332 Neutrophil elastase BV6Y2P [(S)-1-((2S,3S)-2-Benzyloxy-4-oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 44279792 C27H27N3O5 473.5 C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@@H](NC2=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BVP1Q6 (3S)-1-Diazo-3-[(aminoacetyl)amino]-4-(4-iodophenyl)-2-butanone Investigative 102323332 C12H13IN4O2 372.16 C1=CC(=CC=C1C[C@@H](C(=O)C=[N+]=[N-])NC(=O)CN)I IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BVW60I 2-Chloro-5-[[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxoimidazol-1-yl]sulfamoyl]benzoic acid Investigative 44415219 C18H14ClN3O5S2 451.9 CSC1=CC=C(C=C1)/C=C\\2/C(=O)N(C=N2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O IC50 = 75800 nM Poor binder T40332 Neutrophil elastase BW47VB 2-[[5-(4-Chlorophenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl]-N-(pyridin-3-ylmethyl)acetamide Investigative 3223864 C18H14ClN5OS2 415.9 C1=CC(=CN=C1)CNC(=O)CSC2=NN=C3N2C(=CS3)C4=CC=C(C=C4)Cl IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BW86IX [(S)-1-((S)-2-Oxo-azetidin-3-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid benzyl ester Investigative 44279951 C20H21N3O4 367.4 C1[C@@H](C(=O)N1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BW8IC4 Chembl4168536 Investigative 145953439 C25H30O6 426.5 CC1(CCC2=C(C3=C(C=C2O1)O[C@@H](CC3=O)C4=CC=C(C=C4)O)O)CCCC(C)(C)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BWA3N8 Elasnin Investigative 54685126 C24H40O4 392.6 CCCCCC(=O)C(CCCC)C1=C(C(=C(C(=O)O1)CCCC)O)CCCC Ki = 93325.43 nM Poor binder T40332 Neutrophil elastase BX0G5F 2-(3,5-Difluoropyridin-2-yl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide Investigative 44561893 C12H10F2N2O3S 300.28 C1CCC2=C(C1)C(=O)N(S2(=O)=O)C3=C(C=C(C=N3)F)F IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BX1D3Z 4-Hydroxy-6-undecyl-1H-pyridin-2-one Investigative 54728809 C16H27NO2 265.39 CCCCCCCCCCCC1=CC(=CC(=O)N1)O IC50 = 153000 nM Poor binder T40332 Neutrophil elastase BX1D6A (2S)-1-[(2S)-3-Methyl-2-[[4-(morpholine-4-carbonyl)benzoyl]amino]butanoyl]-N-(3,3,4,4,4-pentafluoro-2-oxobutyl)pyrrolidine-2-carboxamide Investigative 10371190 C26H31F5N4O6 590.5 CC(C)[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)C(C(F)(F)F)(F)F)NC(=O)C2=CC=C(C=C2)C(=O)N3CCOCC3 Ki = 150000 nM Poor binder T40332 Neutrophil elastase BX3I0E Ethyl 1-(2-methylbenzoyl)indazole-3-carboxylate Investigative 56663149 C18H16N2O3 308.3 CCOC(=O)C1=NN(C2=CC=CC=C21)C(=O)C3=CC=CC=C3C IC50 = 52000 nM Poor binder T40332 Neutrophil elastase BXE52A 2-Benzylsulfanyl-4-oxo-N-[(1R)-1-phenylethyl]azetidine-1-carboxamide Investigative 482283 C19H20N2O2S 340.4 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CC=CC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BXQ65N N-Benzyl-2-(4-benzyl-5-cyclopropyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide Investigative 1457429 C21H22N4OS 378.5 C1CC1C2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CC=C4 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BY81PJ (S)-N1-(1-(Benzo[d]oxazol-2-yl)-1-oxopropan-2-yl)-2-((S)-2-(3,3-dimethylbutanamido)-3,3-dimethylbutanamido)-N4,N4-dimethylsuccinamide Investigative 10506703 C28H41N5O6 543.7 CC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)[C@H](CC(=O)N(C)C)NC(=O)[C@H](C(C)(C)C)NC(=O)CC(C)(C)C IC50 = 183000 nM Poor binder T40332 Neutrophil elastase BYU1X7 (2S)-3',5'-Dimethoxy-4',5,7-trihydroxy-6-[(2E)-3,7-dimethyl-2,6-octadienyl]-2,3-dihydroflavone Investigative 24854123 C27H32O7 468.5 CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)O[C@@H](CC2=O)C3=CC(=C(C(=C3)OC)O)OC)O)/C)C IC50 = 71300 nM Poor binder T40332 Neutrophil elastase BYW67N 6-O-Z-Pcoumaroyl scandoside methyl ester Investigative 44584783 C26H30O13 550.5 COC(=O)C1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2CO)OC(=O)/C=C\\C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BYZO65 [4-Oxo-6-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]pyran-3-yl] 2-methoxybenzoate Investigative 72793745 C22H16N2O5S2 452.5 COC1=CC=CC=C1C(=O)OC2=COC(=CC2=O)CSC3=NN=C(S3)C4=CC=CC=C4 IC50 ~ 50000 nM Poor binder T40332 Neutrophil elastase BZ20PF N-((1R)-1-Phenylethyl)[2-oxo-4-(4-pyridylmethylthio)azetidinyl]carboxamide Investigative 482285 C18H19N3O2S 341.4 C[C@H](C1=CC=CC=C1)NC(=O)N2C(CC2=O)SCC3=CC=NC=C3 IC50 ~ 75000 nM Poor binder T40332 Neutrophil elastase BZ24RN (1R,21S,24S)-21-Tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-16,16-dimethyl-3,19,22-trioxo-2,18-dioxa-4,20,23-triazatetracyclo[21.2.1.14,7.06,11]heptacosa-6(11),7,9-triene-24-carboxamide Investigative 46228924 C38H53N5O9S 755.9 CC1(CCCCC2=C3CN(CC3=CC=C2)C(=O)O[C@@H]4C[C@H](N(C4)C(=O)[C@@H](NC(=O)OC1)C(C)(C)C)C(=O)N[C@@]5(C[C@H]5C=C)C(=O)NS(=O)(=O)C6CC6)C IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BZ7A2V Tomentin B Investigative 71659628 C26H32O7 456.5 CC1(CCC2=C(C3=C(C=C2O1)O[C@@H](CC3=O)C4=CC(=C(C=C4)OC)O)O)CCCC(C)(C)O IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase BZH72A 1-(4-Chlorophenyl)-3-[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]urea Investigative 1011274 C17H16ClN5O3S2 437.9 CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)Cl IC50 = 78300 nM Poor binder T40332 Neutrophil elastase BZI1U2 3,5-Dibutyl-4-hydroxy-6-(1-oxo-1-phenylhexan-2-yl)pyran-2-one Investigative 54707146 C25H34O4 398.5 CCCCC1=C(C(=C(OC1=O)C(CCCC)C(=O)C2=CC=CC=C2)CCCC)O Ki = 95499.26 nM Poor binder T40332 Neutrophil elastase BZI2E0 (4R)-4-[[(2S)-2-Acetamido-3-carboxypropanoyl]amino]-5-[[(2S,3S)-3-methyl-1-[[(2S)-3-methyl-1-[(2S,4R)-2-[[methyl-[[(1S)-1-phenylethyl]carbamoyl]amino]carbamoyl]-4-phenylmethoxypyrrolidin-1-yl]-1-oxobutan-2-yl]amino]-1-oxopentan-2-yl]amino]-5-oxopentanoic acid Investigative 644152 C44H62N8O12 895 CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](C[C@H]1C(=O)NN(C)C(=O)N[C@@H](C)C2=CC=CC=C2)OCC3=CC=CC=C3)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)C IC50 = 168000 nM Poor binder T40332 Neutrophil elastase BZRS93 2-(4,5-Dibenzyl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-furan-2-ylmethyl-acetamide Investigative 1170184 C23H22N4O2S 418.5 C1=CC=C(C=C1)CC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NCC4=CC=CO4 IC50 ~ 100000 nM Poor binder T40332 Neutrophil elastase D0I0TB Emodin Investigative 3220 C15H10O5 270.24 CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O IC50 = 52000 nM Poor binder T40332 Neutrophil elastase D0S5RY S 3025 Investigative 4784 C7H7FO2S 174.19 C1=CC=C(C=C1)CS(=O)(=O)F IC50 = 52161.7 nM Poor binder