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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03246618

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LUX(3R,3'R,6'S,9R,9'R,13R,13'S)-4',5'-
DIDEHYDRO-5',6',7',8',9,9',10,10',11,11',12,12',13,13',14,14',15,15'-
OCTADECAHYDRO-BETA,BETA-CAROTENE-
3,3'-DIOL
A,B,C2BHW0.81
V2H(1S,3R,5Z,7E,22E)-9,10-secoergosta-
5,7,10,22-tetraene-1,3-diol
A,B3DL90.71
LUT(3R,3'R,6S)-4,5-DIDEHYDRO-5,6-DIHYDRO-
BETA,BETA-CAROTENE-3,3'-DIOL
A,B,C,D,E,F,
G,H,I,J
1RWT0.82
ATE16,17-ANDROSTENE-3-OLA,B1XNX0.74
JB1(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-
1-[(2R,3S)-3-(2-hydroxyethyl)heptan-
2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-
1H-inden-4-ylidene]ethylidene]-
4-methylidene-cyclohexane-1,3-diol
A2ZXM0.7
RTLRETINOLA1IIU0.77
RTLRETINOLA1KT70.77
RTLRETINOLA1KT30.77
RTLRETINOLA1KT50.77
RTLRETINOLA1CRB0.77
RTLRETINOLA1HBP0.77
RTLRETINOLA1EII0.77
RTLRETINOLA1KT60.77
RTLRETINOLA1BRP0.77
RTLRETINOLE,F1QAB0.77
RTLRETINOLE,F3BSZ0.77
RTLRETINOLA,B1FML0.77
RTLRETINOLA1KT40.77
RTLRETINOLA1RBP0.77
RTLRETINOLA1KGL0.77
RTLRETINOLA1MX80.77
RTLRETINOLA,B1FMJ0.77
RTLRETINOLB1FBM0.77
RTLRETINOLA1KQW0.77
RTLRETINOLA2RCT0.77
RTLRETINOLA1AQB0.77
RTLRETINOLA1GX80.77
MC9CALCIPOTRIOLA1S190.71
ERGERGOSTEROLA1BXM0.71
ERGERGOSTEROLA1ZHZ0.71
ERGERGOSTEROLA,B2AIB0.71
CLRCHOLESTEROLA,B2ZXE0.72
CLRCHOLESTEROLA1N830.72
CLRCHOLESTEROLA2RH10.72
CLRCHOLESTEROLA1LRI0.72
CLRCHOLESTEROLA1ZHY0.72
CLRCHOLESTEROLA3D4S0.72
VD3(1S,3Z)-3-[(2E)-2-[(1R,3AR,7AS)-
7A-METHYL-1-[(2R)-6-METHYLHEPTAN-
2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-
INDEN-4-YLIDENE]ETHYLIDENE]-4-METHYLIDENE-
CYCLOHEXAN-1-OL
A2GJ50.71
VD3(1S,3Z)-3-[(2E)-2-[(1R,3AR,7AS)-
7A-METHYL-1-[(2R)-6-METHYLHEPTAN-
2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-
INDEN-4-YLIDENE]ETHYLIDENE]-4-METHYLIDENE-
CYCLOHEXAN-1-OL
A,B3C6G0.71
3OL1-OCTEN-3-OLA,B1HN20.71
3OL1-OCTEN-3-OLA,B1GT30.71
3OL1-OCTEN-3-OLA,B1GT10.71
3OL1-OCTEN-3-OLA,B1G850.71
EB1SEOCALCITOLA1S0Z0.72
LANLANOSTEROLA1W6K0.72
D2V(3S,5Z,7E,22E)-9,10-secoergosta-
5,7,10,22-tetraen-3-ol
A,B3CZH0.72
JC1(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-
1-[(2S,3S)-3-(2-hydroxyethyl)heptan-
2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-
1H-inden-4-ylidene]ethylidene]-
4-methylidene-cyclohexane-1,3-diol
A2ZXN0.7
HCR7-HYDROXYCHOLESTEROLA1ZHT0.75
3ON(3R)-3-HYDROXY-8'-APOCAROTENOLA,B,C,D2BIW0.81