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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02474112

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PZD(11aS)-7,8-dimethoxy-2-naphthalen-
2-yl-1,10,11,11a-tetrahydro-5H-
pyrrolo[2,1-c][1,4]benzodiazepin-
5-one
A,B2K4L0.71
SLX(13aS)-3,10-dimethoxy-5,8,13,13a-
tetrahydro-6H-isoquino[3,2-a]isoquinoline-
2,9-diol
A3FW90.8
GNT(-)-GALANTHAMINEA1DX60.72
GNT(-)-GALANTHAMINEA1QTI0.72
GNT(-)-GALANTHAMINEA,B,C,D,E2PH90.72
GNT(-)-GALANTHAMINEA,B1W760.72
GNT(-)-GALANTHAMINEA1W6R0.72
LO22-{4-[butyl(3-chloro-4,5-dimethoxybenzyl)amino]phenyl}-
1,1,1,3,3,3-hexafluoropropan-2-
ol
A,B,C,D3FAL0.75
AEJ(1S)-1-{4-[(9AR)-OCTAHYDRO-2H-PYRIDO[1,2-
A]PYRAZIN-2-YL]PHENYL}-2-PHENYL-
1,2,3,4-TETRAHYDROISOQUINOLIN-6-
OL
A,B,C,D1XQC0.74
RO01-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY-
4-{[4-(2-METHOXYPHENYL)PIPERIDIN-
1-YL]METHYL}ISOQUINOLINE
A2FVJ0.72
PTI2-PHENYL-1-[4-(2-PIPERIDIN-1-YL-
ETHOXY)-PHENYL]-1,2,3,4-TETRAHYDRO-
ISOQUINOLIN-6-OL
A1UOM0.78
J67(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin-
8-yl)methyl]-4-[(E)-2-phenylethenyl]-
1H-indole-2,3-dione 3-oxime
X3G9L0.7
PFH6,7-DIMETHOXY-4-[(3R)-3-(2-NAPHTHYLOXY)PYRROLIDIN-
1-YL]QUINAZOLINE
A2OVV0.7
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,B2CFD0.71
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,B2CFG0.71
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
A2BT30.71
451N-(6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin-
2-yl)acetamide
A3FYX0.71
E201-BENZYL-4-[(5,6-DIMETHOXY-1-INDANON-
2-YL)METHYL]PIPERIDINE
A1EVE0.72
RPF1-{4-[3-(2-METHOXY-BENZYLOXY)-PROPOXY]-
PHENYL}-6-(1,2,,3,4-TETRAHYDRO-
QUINOLIN-7-YLOXYMETHYL)-PIPERAZIN-
2-ONE
A,B2BKT0.73
380(2R)-2-({4-[AMINO(IMINO)METHYL]PHENYL}AMINO)-
N-BENZYL-2-(3,4-DIMETHOXYPHENYL)ACETAMIDE
H,L1W2K0.7
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,L1Q0Y0.7
MXX5,8-dimethoxy-1,4-dimethylquinolin-
2(1H)-one
A,B3GAM0.72
BERBERBERINEA3D6Y0.77
BERBERBERINEA,B,D,E1JUM0.77
BERBERBERINEA,B,D,E3BTI0.77
BERBERBERINEA2QVD0.77
AI32,3-DIMETHOXY-12H-[1,3]DIOXOLO[5,6]INDENO[1,2-
C]ISOQUINOLIN-6-IUM
A,C,D1TL80.73
J88(3Z)-1-[(6-fluoro-4H-1,3-benzodioxin-
8-yl)methyl]-4-phenyl-1H-indole-
2,3-dione 3-oxime
A3G9N0.7
DRF(2S)-2-ETHOXY-3-{4-[2-(10H-PHENOXAZIN-
10-YL)ETHOXY]PHENYL}PROPANOIC ACID
A1NYX0.7
DPDA,B1QIW0.73
DPDA1QIV0.73
REN(S)-reticulineA3FWA0.81
REN(S)-reticulineA3D2D0.81
ROSN,N'-TETRAMETHYL-ROSAMINEA1F1T0.74
7714-(4-BENZYLOXY-2-METHANESULFONYLAMINO-
5-METHOXY-BENZYLAMINO)-BENZAMIDINE
H,L1W0Y0.73
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.71
11RRUTHENIUM WIRE, 11 CARBON LINKERA2CG10.71
XM56-methoxy-9-methyl[1,3]dioxolo[4,5-
h]quinolin-8(9H)-one
A,B3G5M0.73
ZD64-BROMO-2-FLUORO-N-[(4E)-6-METHOXY-
7-[(1-METHYLPIPERIDIN-4-YL)METHOXY]QUINAZOLIN-
4(1H)-YLIDENE]ANILINE
A2IVU0.7
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.85
DEH2,9-dihydroxy-3,10-dimethoxy-5,6-
dihydroisoquino[3,2-a]isoquinolinium
A3GSY0.74
QUMQUINACRINE MUSTARDA,B1GXF0.72
GSG1S,3AS,8AS-TRIMETHYL-1-OXIDO-1,2,3,3A,8,8A-
HEXAHYDROPYRROLO[2,3-B]INDOL-5-
YL 2-ETHYLPHENYLCARBAMATE
A2BAG0.73