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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00884322

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
R9ARUTHENIUM WIRE, 9 CARBON LINKERA2CG00.71
J88(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin-
8-yl)methyl]-4-phenyl-1H-indole-
2,3-dione 3-oxime
A3G9N0.71
R7URUTHENIUM WIRE, 7 CARBON LINKERA2CFW0.71
TQD(2R,6S)-6-{[methyl(3,4,5-trimethoxyphenyl)amino]methyl}-
1,2,5,6,7,8-hexahydroquinazoline-
2,4-diamine
A1S3V0.71
TQD(2R,6S)-6-{[methyl(3,4,5-trimethoxyphenyl)amino]methyl}-
1,2,5,6,7,8-hexahydroquinazoline-
2,4-diamine
A1S3U0.71
R6ARUTHENIUM WIRE, 6 CARBON LINKERA2CFL0.71
R5BRUTHENIUM WIRE WC5A2CFK0.71
AI32,3-DIMETHOXY-12H-[1,3]DIOXOLO[5,6]INDENO[1,2-
C]ISOQUINOLIN-6-IUM
A,C,D1TL80.71
ZD64-BROMO-2-FLUORO-N-[(4E)-6-METHOXY-
7-[(1-METHYLPIPERIDIN-4-YL)METHOXY]QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2IVU0.71
OXIOXOLINIC ACIDA,B1KSE0.72
J72(3E)-5-fluoro-1-[(6-fluoro-4H-1,3-
benzodioxin-8-yl)methyl]-1H-indole-
2,3-dione 3-oxime
X3G900.7
I3N1-BENZYL-5-METHOXY-2-METHYL-1H-
INDOL-3-YL)-ACETIC ACID
A1DCY0.7
IRE3-CHLORO-4-FLUORO-N-[(4Z)-7-METHOXY-
6-(3-MORPHOLIN-4-YLPROPOXY)QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2ITZ0.71
IRE3-CHLORO-4-FLUORO-N-[(4Z)-7-METHOXY-
6-(3-MORPHOLIN-4-YLPROPOXY)QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2ITO0.71
IRE3-CHLORO-4-FLUORO-N-[(4Z)-7-METHOXY-
6-(3-MORPHOLIN-4-YLPROPOXY)QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2ITY0.71
J67(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin-
8-yl)methyl]-4-[(E)-2-phenylethenyl]-
1H-indole-2,3-dione 3-oxime
X3G9L0.71
CIA6-BENZO[1,3]DIOXOL-5-YL-2-METHYL-
2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4-
B]INDOLE-1,4-DIONE
A,B1UDU0.72
CIA6-BENZO[1,3]DIOXOL-5-YL-2-METHYL-
2,3,6,7,12,12A-HEXAHYDRO-PYRAZINO[1',2':1,6]PYRIDO[3,4-
B]INDOLE-1,4-DIONE
A1XOZ0.72
ROSN,N'-TETRAMETHYL-ROSAMINEA1F1T0.74
7714-(4-BENZYLOXY-2-METHANESULFONYLAMINO-
5-METHOXY-BENZYLAMINO)-BENZAMIDINE
H,L1W0Y0.73
R5ARUTHENIUM WIRE, 5 CARBON LINKERA2CFK0.71
BERBERBERINEA3D6Y0.75
BERBERBERINEA,B,D,E1JUM0.75
BERBERBERINEA,B,D,E3BTI0.75
BERBERBERINEA2QVD0.75
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.74
XM56-methoxy-9-methyl[1,3]dioxolo[4,5-
h]quinolin-8(9H)-one
A,B3G5M0.74