83 complex(es)
PDB ID
Protein Name
Organism
Uniprot ID/ACC
Ligand Name
HET ID
Structure
PS-Score (Pocket Similarity)
Card
51 5OA0 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.5 SHOW
52 5O87 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.5 SHOW
53 5AIN Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) VARENICLINE QMR 0.49 SHOW
54 6SGV Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) Hosieine LDQ 0.49 SHOW
55 6CNK Neuronal acetylcholine receptor subunit alpha4beta-2 Homo sapiens P17787 (ACHB2_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.49 SHOW
56 4ZRU Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 3-[(2S)-pyrrolidin-2-ylethynyl]pyridine TI9 0.49 SHOW
57 3SIO Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) METHYLLYCACONITINE MLK 0.49 SHOW
58 6USF Neuronal acetylcholine receptor subunit alpha-4 Homo sapiens P43681 (ACHA4_HUMAN) VARENICLINE QMR 0.49 SHOW
59 3RQW Gamma-aminobutyric-acid receptor subunit beta-1 Dickeya dadantii E0SJQ4 (E0SJQ4_DICD3) ACETYLCHOLINE ACH 0.48 SHOW
60 6QQO Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 6-[5-[(1~{R},2~{R},4~{S})-7-azabicyclo[2.2.1]heptan-2-yl]-2-fluoranyl-pyridin-3-yl]pyridine-3-carboxamide JC8 0.48 SHOW
61 6QKK Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 4-[5-[(1~{R},2~{R},4~{S})-7-azabicyclo[2.2.1]heptan-2-yl]-2-fluoranyl-pyridin-3-yl]benzamide H92 0.48 SHOW
62 6PV7 Neuronal acetylcholine receptor subunit alpha-3 Homo sapiens P32297 (ACHA3_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.47 SHOW
63 5KXI Neuronal acetylcholine receptor subunit alpha4beta-2 Homo sapiens P17787 (ACHB2_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.47 SHOW
64 5OAL Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.47 SHOW
65 6PV8 Neuronal acetylcholine receptor subunit alpha-3 Homo sapiens P32297 (ACHA3_HUMAN) (3-endo)-N-(2-bromophenyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine P1M 0.47 SHOW
66 5KZU Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 9-[[1-[8-methyl-8-(2-phenylethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]triazol-4-yl]methyl]carbazole 74S 0.46 SHOW
67 3SH1 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) METHYLLYCACONITINE MLK 0.46 SHOW
68 5FJV Neuronal acetylcholine receptor subunit alpha-2 Homo sapiens Q15822 (ACHA2_HUMAN) EPIBATIDINE EPJ 0.45 SHOW
69 5CFB Glycine receptor subunit alpha-3 Homo sapiens O75311 (GLRA3_HUMAN) STRYCHNINE SY9 0.45 SHOW
70 5OBG Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.45 SHOW
71 3JAD Glycine receptor subunit alphaZ1 Danio rerio O93430 (GLRA1_DANRE) STRYCHNINE SY9 0.44 SHOW
72 5BW2 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (2R)-2-(pyridin-3-yl)-1-azabicyclo[2.2.2]octane 4VU 0.44 SHOW
73 6NP0 5-hydroxytryptamine receptor 3A Mus musculus P23979 (5HT3A_MOUSE) 1-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide CWB 0.43 SHOW
74 6CNJ Neuronal acetylcholine receptor subunit alpha4beta-2 Homo sapiens P17787 (ACHB2_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.43 SHOW
75 1LN1 Phosphatidylcholine transfer protein Homo sapiens Q9UKL6 (PPCT_HUMAN) 1,2-DILINOLEOYL-SN-GLYCERO-3-PHOSPHOCHOLINE DLP 0.43 SHOW
76 6SH0 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 1-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]ethanone 4P0 0.43 SHOW
77 2XNU Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 2-(2-(4-PHENYLPIPERIDIN-1-YL)ETHYL)-1H-INDOLE VU3 0.43 SHOW
78 6Y1Z 5-hydroxytryptamine receptor 3A Mus musculus P23979 (5HT3A_MOUSE) (3~{a}~{S})-2-[(3~{S})-1-azabicyclo[2.2.2]octan-3-yl]-3~{a},4,5,6-tetrahydro-3~{H}-benzo[de]isoquinolin-1-one O7B 0.43 SHOW
79 2XNV Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 2-(2-(4-PHENYLPIPERIDIN-1-YL)ETHYL)-1H-INDOLE VU3 0.42 SHOW
80 6ETV Lysine-specific demethylase 4D Homo sapiens Q6B0I6 (KDM4D_HUMAN) [3-(2~{H}-1,2,3,4-tetrazol-5-yl)propanoylamino]azanium BXE 0.42 SHOW
81 5F5A Lysine-specific demethylase 4D Homo sapiens Q6B0I6 (KDM4D_HUMAN) 2-[(furan-2-ylmethylamino)methyl]pyridine-4-carboxylic acid 5V0 0.42 SHOW
82 6X47 Gag-Pol polyprotein Human immunodeficiency virus type 1 group M subtype B P03366 (POL_HV1B1) 7-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy)phenoxy)-2-naphthonitrile 7AX 0.41 SHOW
83 2ZJU Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) (2E)-1-[(6-chloropyridin-3-yl)methyl]-N-nitroimidazolidin-2-imine IM4 0.41 SHOW