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1501 Ligand(s)
Ligand Name
Ligand ID
Structure
#Protein-Ligand Complex(es)
101 [(1S,2S,3R,5S)-5-carboxy-1,2,3-trihydroxycyclohexyl]methanaminium COVPDB1054 2
102 {[(1S,2S,3R,5S)-5-carboxy-1,2,3-trihydroxycyclohexyl]methyl}(hydroxy)azanium COVPDB816 2
103 (1S,2S,3S)-6-[(2,4-dinitrophenoxy)methyl]-3-fluorocyclohex-5-ene-1,2,4-triol COVPDB790 1
104 (1S,2S)-N'-(chloroacetyl)-2-phenylcyclopropane-1-carbohydrazide COVPDB969 1
105 (1S,3R,4S)-3,4-dihydroxy-5-oxocyclohexane-1-carboxylic acid COVPDB817 1
106 (1S,3S)-3-amino-4-(perfluoropropan-2-ylidene)cyclopentane-1-carboxylic acid COVPDB1106 2
107 (1S,5R)-2-{[4-(methylamino)butyl]carbamoyl}-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid COVPDB196 1
108 (1S,5R)-2-{[(4R)-azepan-4-yl]carbamoyl}-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid COVPDB1510 1
109 (1S,5R)-2-{[(4S)-1-(2-aminoethyl)azepan-4-yl]carbamoyl}-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid COVPDB1294 1
110 (1S,5R)-2-{[(4S)-azepan-4-yl]carbamoyl}-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid COVPDB1509 1
111 (1S,7S)-7-amino-7-benzyl-N-[(1S)-4-carbamimidamido-1-{(1S)-1,2-dioxo-2-[(2-phenylethyl)amino]ethyl}butyl]-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carboxamide COVPDB2 1
112 (1S,7S)-7-amino-N-[(2R,3S)-7-amino-1-(cyclohexylamino)-2-keto-1-oxoheptan-3-yl]-7-benzyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carboxamide COVPDB1 1
113 1-thioxy-3-hydroxy-acetone COVPDB1305 1
114 2-(1,4,5,6-tetrahydropyrimidin-2-yl)benzenethiol COVPDB776 1
115 2-((1-(4-Bromophenyl)-1H-1,2,3-triazol-4-yl)methyl)-4,4-dimethyl-1,2-thiazetidin-3-one 1,1-dioxide COVPDB963 1
116 2-[(1R,3R,7E,17beta)-1,3-Dihydroxy-2-methylidene-9,10-secoestra-5,7-dien-17-yl]-oct-6-en-4-yn-3-one COVPDB448 1
117 (2-{[2-({1-[2-(2,4-dichlorophenoxy)acetyl]piperidin-4-yl}formamido)ethyl]disulfanyl}ethyl)trimethylazanium COVPDB105 1
118 2-(2-(3,4-DICHLOROPHENYL)-5-(ISOPROPYLAMINO)-6-OXOPYRIMIDIN-1(6H)-YL)-N-((S)-1-OXO-1-(THIAZOL-2-YL)-5-GUANIDINOPENTAN-2-YL)ACETAMIDE COVPDB290 1
119 2-({2',3',4'-trifluoro-[1,1'-biphenyl]-2-yl}oxy)acetaldehyde COVPDB1384 1
120 2,2'-ethyne-1,2-diylbis{5-[(chloroacetyl)amino]benzenesulfonic acid COVPDB774 1
121 2-((2-naphthoyl)-L-valyl)-4-hydroxy-N-((3S)-2-hydroxy-5-oxotetrahydrofuran-3-yl)-2-azabicyclo[2.2.2]octane-3-carboxamide COVPDB1455 1
122 2-(2-phosphono-ethyl)-acrylic acid 4-nitro-phenyl ester COVPDB666 1
123 2-[(2~{S},6~{R})-2,6-dimethylpiperidin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzoxazin-4-one COVPDB822 1
124 (2-{[3-({1-[2-(2,4-dichlorophenoxy)acetyl]piperidin-4-yl}carbamoyl)propyl]disulfanyl}ethyl)trimethylazanium COVPDB104 1
125 2, 3-(4-BENZENESULFONYL-THIOPHENE-2-SULFONYLAMINO)-PHENYLBORONIC ACID COVPDB770 1
126 2-(3,4-dichlorophenyl)-N-(2-{[2-(dimethylamino)ethyl]disulfanyl}ethyl)acetamide COVPDB856 1
127 2-((3-acrylamidophenyl)(2-(piperidin-1-yl)ethoxy)methyl)thieno[3,2-b]pyridine-7-carboxylic acid COVPDB889 1
128 2-(3-chloro-2-fluorophenyl)-2,3-dihydro-1,2-thiazol-3-one COVPDB469 1
129 [2-[(3-chlorophenyl)methoxy]phenyl]boronic acid COVPDB306 1
130 2,3-difluoro-KDN COVPDB803 1
131 2,3-difluoro-N-acetylneuramic acid COVPDB814 8
132 2,3-Dihexanoyl-sn-glycerol COVPDB192 2
133 2,3- epoxypropyl-alpha-D-glucopyranoside COVPDB765 2
134 2,3-EPOXYPROPYL-BETA-D-XYLOSIDE COVPDB606 1
135 2-[4-({2-[(2S,5R)-2-cyano-5-ethynylpyrrolidin-1-yl]-2-oxoethyl}amino)-4-methylpiperidin-1-yl]pyridine-4-carboxylic acid COVPDB515 1
136 2-(4-chlorophenoxy)-N-(2-{[2-(dimethylamino)ethyl]disulfanyl}ethyl)-2-methylpropanamide COVPDB853 1
137 2-(4-chlorophenoxy)-N-(3-{[2-(dimethylamino)ethyl]disulfanyl}propyl)-2-methylpropanamide COVPDB852 1
138 2,4-diamino-6-(3-formylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile COVPDB1206 1
139 2,4-diaminopteridine-6-carbaldehyde COVPDB386 1
140 2,4-DINITROPHENYL-2-DEOXY-2-FLUORO-BETA-D-CELLOBIOSIDE COVPDB684 1
141 2,4‐dioxo‐1,3,2lambda5‐benzodioxaphosphinin‐2‐olate COVPDB152 1
142 2-(4-hydroxyphenyl)-N-(5-methylene-2-oxotetrahydrofuran-3-yl)acetamide COVPDB1178 1
143 (2-{[4-(isoquinoline-5-sulfonyl)-1,4-diazepan-1-yl]methyl}phenyl)boronic acid COVPDB592 1
144 2-(4-methylpiperazin-1-yl)-3-(phenylsulfanyl)naphthalene-1,4-dione COVPDB453 1
145 2-(4-phenoxyphenoxy)-6-[(1S,4S)-5-(prop-2-enoyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyridine-3-carboxamide COVPDB865 1
146 2-[(4R)-4-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(1,5-dihydroxy-4-oxopyridin-2-yl)methoxy]imino}acetamido]-3-oxo-1,2-oxazolidin-2-yl]-5-oxooxolane-2-carboxylic acid COVPDB154 1
147 2-[5-AMINO-6-OXO-2-(2-THIENYL)-1,6-DIHYDROPYRIMIDIN-1-YL)-N-[3,3-DIFLUORO -1-ISOPROPYL-2-OXO-3-(N-(2-MORPHOLINO ETHYL)CARBAMOYL]PROPYL]ACETAMIDE COVPDB551 1
148 2-(5-AMINO-6-OXO-2-M-TOLYL-6H-PYRIMIDIN-1-YL)-N-[4-GUANIDINO-1-(THIAZOLE-2-CARBONYL)-BUTYL]-ACETAMIDE COVPDB291 1
149 2-(5-BENZYLAMINO-2-METHYLSULFANYL-6-OXO-6H-PYRIMIDIN-1-YL)-N-[4-GUANIDINO-1-(THIAZOLE-2-CARBONYL)-BUTYL]-ACETAMIDE COVPDB292 1
150 [2,5-bis(oxidanylidene)pyrrolidin-1-yl] (1~{S},5~{R})-6-[1-(4-fluorophenyl)pyrazol-3-yl]-3-azabicyclo[3.1.0]hexane-3-carboxylate COVPDB735 1