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821 Ligand(s)
Ligand Name
HET ID
Structure
#Protein-Ligand Complex(es)
101 1-(2,4-dimethylbenzyl)-6-oxo-1,6-dihydropyridine-3-carboxamide IWH 2
102 methyl (R)-N-[(1E)-1-(diethylamino)ethylidene]-P-methylphosphonamidate L0S 2
103 4'-NITROPHENYL-S-(BETA-D-GLUCOPYRANOSYL)-(1-3)-(3-THIO-BETA-D-GLUCOPYRANOSYL)-(1-3)-BETA-D-GLUCOPYRANOSIDE LAM 2
104 (2R,3R,4R,5R)-2-((1S,2S,3R,4S,6R)-4,6-DIAMINO-3-((2R,3R,6S)-3-AMINO-6-(AMINOMETHYL)-TETRAHYDRO-2H-PYRAN-2-YLOXY)-2-HYDROXYCYCLOHEXYLOXY)-5-METHYL-4-(METHYLAMINO)-TETRAHYDRO-2H-PYRAN-3,5-DIOL LLL 2
105 trimethyl-[(2S)-1-oxidanyl-1-oxidanylidene-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propan-2-yl]azanium LW8 2
106 [[(2R,3S,4R,5R)-5-(6-AMINO-3-METHYL-4-OXO-5H-IMIDAZO[4,5-C]PYRIDIN-1-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHOXY-HYDROXY-PHOSPHORYL] PHOSPHONO HYDROGEN PHOSPHATE MGO 2
107 METHYLLYCACONITINE MLK 2
108 (2Z)-1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-imine N2Y 2
109 N,N-bis(3-aminopropyl)butane-1,4-diamine N4P 2
110 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione REF 2
111 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID NHE 2
112 3-CARBOXY-N,N,N-TRIMETHYLPROPAN-1-AMINIUM NM2 2
113 NOR-N-OMEGA-HYDROXY-L-ARGININE NNH 2
114 (1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE OIN 2
115 L-ornithine ORN 2
116 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE PCW 2
117 PYRIDINE-2,4-DICARBOXYLIC ACID PD2 2
118 2-AMINO-6-HYDROXYMETHYL-7,8-DIHYDRO-3H-PTERIDIN-4-ONE PH2 2
119 2-(pyridin-3-yl)-N-(5-{4-[(5-{[(pyridin-3-yl)acetyl]amino}-1,3,4-thiadiazol-2-yl)amino]piperidin-1-yl}-1,3,4-thiadiazol-2-yl)acetamide QAJ 2
120 (R)-(3-aminopropyl)methylphosphinic acid QD7 2
121 (3R)-1-azabicyclo[2.2.2]oct-3-yl hydroxy(diphenyl)acetate QNB 2
122 [4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)-2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE R71 2
123 SEROTONIN SRO 2
124 ~{N}-[5-azanyl-2,4-bis(fluoranyl)phenyl]propane-1-sulfonamide SY4 2
125 THYMIDINE THM 2
126 trimethylamine oxide TMO 2
127 methyl (6-cyano-3-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}-4-methylnaphthalen-1-yl)acetate UMV 2
128 3-(4-phenylbutanoylamino)pyridine-4-carboxylic acid YC8 2
129 2-(2-(4-PHENYLPIPERIDIN-1-YL)ETHYL)-1H-INDOLE VU3 2
130 [[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-sulfanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{R})-5-(2-azanyl-7-methyl-6-oxidanyl-purin-7-ium-9-yl)-4-methoxy-3-oxidanyl-oxolan-2-yl]methyl hydrogen phosphate YDZ 2
131 [4-(6-CHLORO-NAPHTHALENE-2-SULFONYL)-PIPERAZIN-1-YL]- (3,4,5,6-TETRAHYDRO-2H-[1,4']BIPYRIDINYL-4-YL)- METHANONE ZEN 2
132 (2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acid M2L 2
133 [2-(phenylamino)benzene-1,4-diyl]bis{[4-(pyrrolidin-1-yl)piperidin-1-yl]methanone} UWN 2
134 (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl-4-yl]-2-hydroxy-4,4-dimethylmorpholin-4-ium HC7 2
135 (2S,2'S)-2,2'-biphenyl-4,4'-diylbis(2-hydroxy-4,4-dimethylmorpholin-4-ium) HC6 2
136 LEUCINE LEU 2
137 [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate HYO 2
138 4-methyl-2,3,4,5,6,7-hexahydrodicyclopenta[b,e]pyridin-8(1H)-imine 36X 2
139 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-{4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl}benzamide 0LI 2
140 5,6,7,8-TETRAHYDROBIOPTERIN H4B 1
141 4-Cl-Bn7GpppG mRNA 5' cap analog OYW 1
142 5-[2-(1H-pyrrol-1-yl)ethoxy]-1H-indole 00G 1
143 1-(5-ethoxypyridin-3-yl)-1,4-diazepane 09P 1
144 1-(5-phenylpyridin-3-yl)-1,4-diazepane 09Q 1
145 1-(6-bromopyridin-3-yl)-1,4-diazepane 09R 1
146 4-[(2S)-2-(methylamino)propyl]phenol 1WF 1
147 1-[(7-carbamimidoylnaphthalen-2-yl)methyl]-6-({1-[(1Z)-ethanimidoyl]piperidin-4-yl}oxy)-2-(propan-2-yl)-1H-indole-4-carboxylic acid 0CA 1
148 (3R)-1-azabicyclo[2.2.2]oct-3-yl[bis(5-chlorothiophen-2-yl)]methanol 0H7 1
149 (3-exo)-8,8-dimethyl-3-(4-{[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]methyl}-1H-1,2,3-triazol-1-yl)-8-azoniabicyclo[3.2.1]octane 0J0 1
150 2'-deoxy-5'-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]cytidine 0KX 1