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821 Ligand(s)
Ligand Name
HET ID
Structure
#Protein-Ligand Complex(es)
51 (2S,3R,5S)-5-(6-amino-9H-purin-9-yl)-tetrahydro-2-(hydroxymethyl)furan-3-ol 3L1 1
52 6-AMINO-3-METHYLPURINE 3MA 1
53 3-bromo-N-[3-(tert-butylamino)propyl]benzamide 3OO 1
54 5-{4-[2-(4-bromophenoxy)ethyl]piperazin-1-yl}-4H-1,2,4-triazol-3-amine 3RM 1
55 5-cyano-2'-{4-[2-(3-methyl-1H-indol-1-yl)ethyl]piperazin-1-yl}-N-[3-(pyrrolidin-1-yl)propyl]biphenyl-3-carboxamide 3UJ 1
56 N-methyl-1-[4-(1H-pyrazol-1-ylmethyl)phenyl]methanamine 3VR 1
57 4-(diethylamino)benzaldehyde 3W9 1
58 N-[(2S)-3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-hydroxypropyl]-6-(oxetan-3-ylamino)pyrimidine-4-carboxamide 3XV 2
59 2-(3,4-dichlorophenyl)ethanamine 42J 1
60 6-CHLORO-N-{(3S)-1-[(1S)-1-(DIMETHYLAMINO)-2,3-DIHYDRO-1H-INDEN-5-YL]-2-OXO-3-PYRROLIDINYL}-2-NAPHTHALENESULFONAMIDE 439 1
61 4-carboxy-1,1-dimethylpiperidin-1-ium 449 1
62 6-chloro-N-{(3S)-1-[(2S)-1-{(1R,5S)-7-[2-(methylamino)ethyl]-3,7-diazabicyclo[3.3.1]non-3-yl}-1-oxopropan-2-yl]-2-oxopyrrolidin-3-yl}naphthalene-2-sulfonamide 44I 1
63 (3R,4R)-1-SULFAMOYL-PYRROLIDINE-3,4-DICARBOXYLIC ACID 3-[(4-CHLORO-PHENYL)-AMIDE] 4-{[2-FLUORO-4-(2-OXO-2H-PYRIDIN-1-YL)-PHENYL]-AMIDE} 455 1
64 4-[(3S)-3-({[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfonyl}amino)-2-oxopyrrolidin-1-yl]-3-fluoro-N,N-dimethylbenzamide 48U 1
65 6-{[(1S)-1-(4-chlorophenyl)ethyl]amino}-1-cyclopentyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one 49D 1
66 (4S)-2-METHYL-1,4,5,6-TETRAHYDROPYRIMIDINE-4-CARBOXYLIC ACID 4CS 1
67 N-[2-(5,6-dimethyl-1H-benzimidazol-2-yl)ethyl]-4-(4H-1,2,4-triazol-4-yl)benzamide 4K6 1
68 isoquinoline-3-carboxylic acid 4K8 1
69 N~2~-[(6-chloronaphthalen-2-yl)sulfonyl]-N~2~-{(3S)-1-[(2S)-1-(4-methyl-1,4-diazepan-1-yl)-1-oxopropan-2-yl]-2-oxopyrrolidin-3-yl}glycinamide 4O1 1
70 4-[(3S)-3-({[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfonyl}amino)-2-oxo-2,3-dihydro-1H-pyrrol-1-yl]-3-fluoro-N-methylbenzamide 4O5 1
71 1-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]ethanone 4P0 2
72 (2S)-(3'-AMIDINO-3-BIPHENYL)-5-(4-PYRIDYLAMINO)PENTANOIC ACID 4PP 1
73 3-AMINOPYRIDINE-4-CARBOXYLIC ACID 4SV 1
74 N-[(1R,3S)-3-({5-fluoro-2-[5-fluoro-2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-4-yl}amino)cyclohexyl]pyrrolidine-1-carboxamide 4V7 1
75 (2R)-2-(pyridin-3-yl)-1-azabicyclo[2.2.2]octane 4VU 1
76 7-oxo-5-phenyl-6-(propan-2-yl)-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile 50P 1
77 6,7-dichloro-N-cyclopentyl-4-(pyridin-4-yl)phthalazin-1-amine 539 1
78 chrysin 57D 1
79 6-methoxy-5-[(4-{[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino}piperidin-1-yl)methyl]-1H-indole-2-carbonitrile 58O 1
80 5'-DEOXYADENOSINE 5AD 1
81 5'-CHLORO-5'-DEOXYADENOSINE 5CD 1
82 5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE 5CM 1
83 (3E)-3-(dibenzo[b,e]oxepin-11(6H)-ylidene)-N,N-dimethylpropan-1-amine 5EH 1
84 ADENOSINE-5'-PENTAPHOSPHATE 5FA 3
85 GUANOSINE-5'-MONOPHOSPHATE 5GP 1
86 4-(2-chloro-6-nitrophenoxy)-N-[2-(diethylamino)ethyl]benzenesulfonamide 5GZ 1
87 {[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACID 5HG 1
88 N-{[(3R)-1-benzylpiperidin-3-yl]methyl}naphthalene-2-sulfonamide 5HH 1
89 (1~{R})-2-[2-azanylidene-3-[(2-methylphenyl)methyl]benzimidazol-1-yl]-1-(3,4-dichlorophenyl)ethanol 5PZ 1
90 1-(3-AMINO-1,2-BENZISOXAZOL-5-YL)-6-(2'-{[(3R)-3-HYDROXYPYRROLIDIN-1-YL]METHYL}BIPHENYL-4-YL)-3-(TRIFLUOROMETHYL)-1,4,5,6-TETRAHYDRO-7H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE 5QC 1
91 ~{N}-[(2~{S})-3-(3,4-dihydro-1~{H}-isoquinolin-2-yl)-2-oxidanyl-propyl]-3-pyridin-2-yl-benzamide 5QH 1
92 (2~{S})-1-(3,4-dihydro-1~{H}-isoquinolin-2-yl)-3-[[4-(3-methylbenzimidazol-5-yl)pyridin-2-yl]amino]propan-2-ol 5QJ 1
93 [4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanamine 5R8 1
94 6-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline 5R9 1
95 5-[(4-methyl-1,4-diazepan-1-yl)methyl]-2-[4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]benzenecarbonitrile 5RA 1
96 ~{N}-(3,3-diphenylpropyl)piperidin-4-amine 5UW 1
97 2-[(furan-2-ylmethylamino)methyl]pyridine-4-carboxylic acid 5V0 1
98 8-[[(phenylmethyl)amino]methyl]-1~{H}-pyrido[3,4-d]pyrimidin-4-one 5V3 1
99 (3R,4R)-1-METHYLCARBAMOYLMETHYL-PYRROLIDINE-3,4-DICARBOXYLIC ACID 3-[(4-CHLORO-PHENYL)-AMIDE] 4-{[2-FLUORO-4-(2-OXO-2H-PYRIDIN-1-YL)-PHENYL]-AMIDE} 63C 1
100 3-CHLORO-N-(4-CHLORO-2-{[(5-CHLOROPYRIDIN-2-YL)AMINO]CARBONYL}-6-METHOXYPHENYL)-4-[(1-METHYL-1H-IMIDAZOL-2-YL)METHYL]THIOPHENE-2-CARBOXAMIDE 663 1