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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03501118

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
11RRUTHENIUM WIRE, 11 CARBON LINKERA2CG10.73
GNT(-)-GALANTHAMINEA1DX60.72
GNT(-)-GALANTHAMINEA1QTI0.72
GNT(-)-GALANTHAMINEA,B,C,D,E2PH90.72
GNT(-)-GALANTHAMINEA,B1W760.72
GNT(-)-GALANTHAMINEA1W6R0.72
REN(S)-reticulineA3FWA0.72
REN(S)-reticulineA3D2D0.72
MOI(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-
HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-
E]ISOQUINOLINE-7,9-DIOL
H,L1Q0Y0.73
GSG1S,3AS,8AS-TRIMETHYL-1-OXIDO-1,2,3,3A,8,8A-
HEXAHYDROPYRROLO[2,3-B]INDOL-5-
YL 2-ETHYLPHENYLCARBAMATE
A2BAG0.71
R5ARUTHENIUM WIRE, 5 CARBON LINKERA2CFK0.7
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.7
PTI2-PHENYL-1-[4-(2-PIPERIDIN-1-YL-
ETHOXY)-PHENYL]-1,2,3,4-TETRAHYDRO-
ISOQUINOLIN-6-OL
A1UOM0.75
LO22-{4-[butyl(3-chloro-4,5-dimethoxybenzyl)amino]phenyl}-
1,1,1,3,3,3-hexafluoropropan-2-
ol
A,B,C,D3FAL0.72
DPDA,B1QIW0.76
DPDA1QIV0.76
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.78
XM56-methoxy-9-methyl[1,3]dioxolo[4,5-
h]quinolin-8(9H)-one
A,B3G5M0.7
R9ARUTHENIUM WIRE, 9 CARBON LINKERA2CG00.7
R4ABIS[1H,1'H-2,2'-BIPYRIDINATO(2-
)-KAPPA~2~N~1~,N~1'~]{3-[4-(1,10-
DIHYDRO-1,10-PHENANTHROLIN-4-YL-
KAPPA~2~N~1~,N~10~)BUTOXY]-N,N-
DIMETHYLANILINATO(2-)}RUTHENIUM
A,B2CFD0.73
R4ABIS[1H,1'H-2,2'-BIPYRIDINATO(2-
)-KAPPA~2~N~1~,N~1'~]{3-[4-(1,10-
DIHYDRO-1,10-PHENANTHROLIN-4-YL-
KAPPA~2~N~1~,N~10~)BUTOXY]-N,N-
DIMETHYLANILINATO(2-)}RUTHENIUM
A,B2CFG0.73
R4ABIS[1H,1'H-2,2'-BIPYRIDINATO(2-
)-KAPPA~2~N~1~,N~1'~]{3-[4-(1,10-
DIHYDRO-1,10-PHENANTHROLIN-4-YL-
KAPPA~2~N~1~,N~10~)BUTOXY]-N,N-
DIMETHYLANILINATO(2-)}RUTHENIUM
A2BT30.73
R7URUTHENIUM WIRE, 7 CARBON LINKERA2CFW0.7
7714-(4-BENZYLOXY-2-METHANESULFONYLAMINO-
5-METHOXY-BENZYLAMINO)-BENZAMIDINE
H,L1W0Y0.72
P324-{[(2S)-3-(tert-butylamino)-2-
hydroxypropyl]oxy}-3H-indole-2-
carbonitrile
A,B,C,D2VT40.7
ROSN,N'-TETRAMETHYL-ROSAMINEA1F1T0.74
R6ARUTHENIUM WIRE, 6 CARBON LINKERA2CFL0.7
R5BRUTHENIUM WIRE WC5A2CFK0.7
SLX(13aS)-3,10-dimethoxy-5,8,13,13a-
tetrahydro-6H-isoquino[3,2-a]isoquinoline-
2,9-diol
A3FW90.7
ZD64-BROMO-2-FLUORO-N-[(4E)-6-METHOXY-
7-[(1-METHYLPIPERIDIN-4-YL)METHOXY]QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2IVU0.72