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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02416036

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DZD5'-O-[(R)-{[(R)-{[(3R,4R)-1-(3-
carbamoylbenzyl)-4-hydroxypyrrolidin-
3-yl]methoxy}(hydroxy)phosphoryl]methyl}(hydroxy)phosphoryl]adenosine		A,D3D4B0.71
AGNA1GNP0.86
GSRA1AF10.8
00A5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosineX3CW80.76
PPUPUROMYCIN-5'-MONOPHOSPHATE51NJP0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z		1VQN0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQO0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,51NJM0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE51NJO0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQL0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,2,3,4,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQM0.72
PPUPUROMYCIN-5'-MONOPHOSPHATE1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1Q820.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.72
PPUPUROMYCIN-5'-MONOPHOSPHATEB1FG00.72
PPUPUROMYCIN-5'-MONOPHOSPHATE1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1Q810.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		3CD60.72
PPUPUROMYCIN-5'-MONOPHOSPHATE0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQP0.72
PUYPUROMYCINA,B2DPT0.73
PUYPUROMYCIN1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1Q7Y0.73
N2GA,P,T2W8K0.77
N2GA,P,T2W8L0.77
NBDN6-BENZYL-NICOTINAMIDE-ADENINE-
DINUCLEOTIDE		A,B,C,D1GYQ0.7
CND5-BETA-D-RIBOFURANOSYLNICOTINAMIDE ADENINE DINUCLEOTIDEA,B1ADB0.72
DOT3'ANTHRANILOYL-2'-DEOXY-ADENOSINE-
5'-TRIPHOSPHATE		A,B,C,D,E,F1LVC0.78
5HI(3R,5R)-7-[2-(4-fluorophenyl)-4-
{[(1S)-2-hydroxy-1-phenylethyl]carbamoyl}-
5-(1-methylethyl)-1H-imidazol-1-
yl]-3,5-dihydroxyheptanoic acid		A,B,C,D3CCZ0.72
CF22'-deoxy-5'-O-{[2-(7,8-dimethyl-
2,4-dioxo-3,4-dihydrobenzo[g]pteridin-
10(2H)-yl)ethyl]carbamoyl}guanosine		A2VKF0.73
YMPO-(ADENOSINE-5'-O-YL)-N-(L-TYROSYL)PHOSPHORAMIDATEX,Y2DLC0.71
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D,E,F1KQO0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B2H290.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1NUQ0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA1WXG0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D,E,F1KAQ0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1EE10.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B,C,D3E270.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA1XQD0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B2H2A0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1IFX0.7
DNDNICOTINIC ACID ADENINE DINUCLEOTIDEA,B1XNG0.7
MNT2'(3')-O-N-METHYLANTHRANILOYL-ADENOSINE-
5'-DIPHOSPHATE		A1LVK0.78
NMDN-NAPHTHALEN-1-YLMETHYL-2'-[3,5-
DIMETHOXYBENZAMIDO]-2'-DEOXY-ADENOSINE		A,B,C,D,E,F1I320.73
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE		A,C1TL70.86
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE		A,C1U0H0.86
GRDbenzyl (S)-1-((2S,3S)-1-(3-(6-amino-
9H-purin-9-yl)propylamino)-2-hydroxy-
1-oxopentan-3-ylamino)-4-methyl-
1-oxopentan-2-ylcarbamate		A2R9C0.72
I2C5'-O-[(S)-hydroxy{[2-hydroxy-3,5-
dimethyl-6-(2-oxoethyl)pyridin-
4-yl]oxy}phosphoryl]guanosine		A3F470.73
I2C5'-O-[(S)-hydroxy{[2-hydroxy-3,5-
dimethyl-6-(2-oxoethyl)pyridin-
4-yl]oxy}phosphoryl]guanosine		A3F460.73
PAD5-BETA-D-RIBOFURANOSYLPICOLINAMIDE ADENINE-
DINUCLEOTIDE		A1A720.71
PAD5-BETA-D-RIBOFURANOSYLPICOLINAMIDE ADENINE-
DINUCLEOTIDE		A,B1ADC0.71
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B2ALY0.72
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B1VBM0.72
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B1VBN0.72
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B2PID0.72
FEG5'-O-[(S)-{[2-(carboxymethyl)-6-
hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine		A3DAG0.75
FEG5'-O-[(S)-{[2-(carboxymethyl)-6-
hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine		A3DAF0.75
NGDA,B2O3U0.74
CAGA1GNQ0.77
CAGA1PLJ0.77
CAGX2EVW0.77
CAGA1GNR0.77
CAGX2CL60.77
RUN2-[(1R,3S,4S)-1-BENZYL-4-[N-(BENZYLOXYCARBONYL)-
L-VALYL]AMINO-3-PHENYLPENTYL]-4(5)-
(2-METHYLPROPIONYL)IMIDAZOLE		B1HPS0.72
MGVP-FLUORO-7-BENZYL GUANINE MONOPHOSPHATEA,E2V8Y0.79
MGQ7-BENZYL GUANINE MONOPHOSPHATEA,E2V8X0.8
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER		A1RVD0.79
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER		A1CLU0.79
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A3CMQ0.72
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A,B1JJC0.72
TNDN-1,2,3,4-TETRAHYDRONAPHTH-1-YL-
2'-[3,5-DIMETHOXYBENZAMIDO]-2'-
DEOXY-ADENOSINE		A,B,C,D,E,F1I330.74
ANZA2V0C0.7
ANZA,B,D,F2V0G0.7
ONAA,C2GVZ0.78
NXXA,B,C,D3DLA0.7
NXXA,B,C2QTR0.7
LNC(3S)-5-(3-CARBOXY-3-HYDROXYPROPYL) NICOTINAMIDE-
ADENINE-DINUCLEOTIDE		A,B5LDH0.7
4HI(3R,5R)-7-[4-(benzylcarbamoyl)-
2-(4-fluorophenyl)-5-(1-methylethyl)-
1H-imidazol-1-yl]-3,5-dihydroxyheptanoic acid		B,C,D3CCW0.71
GSSA1AP10.8
HYCO5'-[9-(3,17B-DIHYDROXY-1,3,5(10)-
ESTRATRIEN-16B-YL)-NONANOYL]ADENOSINE		A1I5R0.71
MS1A,B1OZ00.74
8FGN-(5'-PHOSPHO-2'-DEOXYGUANOSIN-
8-YL)-2-ACETYLAMINOFLUORENE		A,C,D1X9M0.73