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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02272048

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BPG9-(4-HYDROXYBUTYL)-N2-PHENYLGUANINEA,B1QHI0.73
CND5-BETA-D-RIBOFURANOSYLNICOTINAMIDE ADENINE DINUCLEOTIDEA,B1ADB0.7
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A3CMQ0.71
FA5ADENOSINE-5'-[PHENYLALANINYL-PHOSPHATE]A,B1JJC0.71
MNT2'(3')-O-N-METHYLANTHRANILOYL-ADENOSINE-
5'-DIPHOSPHATE
A1LVK0.75
MS1A,B1OZ00.71
I2C5'-O-[(S)-hydroxy{[2-hydroxy-3,5-
dimethyl-6-(2-oxoethyl)pyridin-
4-yl]oxy}phosphoryl]guanosine
A3F470.72
I2C5'-O-[(S)-hydroxy{[2-hydroxy-3,5-
dimethyl-6-(2-oxoethyl)pyridin-
4-yl]oxy}phosphoryl]guanosine
A3F460.72
FR31-((1R)-1-(HYDROXYMETHYL)-3-(1-
NAPHTHYL)PROPYL)-1H-IMIDAZOLE-4-
CARBOXAMIDE
A1NDY0.7
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,D3CCZ0.73
CAGA1GNQ0.76
CAGA1PLJ0.76
CAGX2EVW0.76
CAGA1GNR0.76
CAGX2CL60.76
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE
A,C1TL70.85
ONM3'-O-(N-METHYLANTHRANILOYL)-GUANOSINE-
5'-TRIPHOSPHATE
A,C1U0H0.85
MGVP-FLUORO-7-BENZYL GUANINE MONOPHOSPHATEA,E2V8Y0.77
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER
A1RVD0.75
DBG3-AMINOBENZOPHENONE-4-YL-AMINOHYDROXYPHOSPHINYLAMINOPHOSPHONIC ACID-
GUANYLATE ESTER
A1CLU0.75
9DI9-DEAZAINOSINEA1A9P0.71
PUYPUROMYCINA,B2DPT0.72
PUYPUROMYCIN1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1Q7Y0.72
FR21-((1R)-1-(HYDROXYMETHYL)-3-PHENYLPROPYL)-
1H-IMIDAZOLE-4-CARBOXAMIDE
A1NDW0.73
4HI(3R,5R)-7-[4-(benzylcarbamoyl)-
2-(4-fluorophenyl)-5-(1-methylethyl)-
1H-imidazol-1-yl]-3,5-dihydroxyheptanoic acid
B,C,D3CCW0.72
GSRA1AF10.79
N2GA,P,T2W8K0.74
N2GA,P,T2W8L0.74
DOT3'ANTHRANILOYL-2'-DEOXY-ADENOSINE-
5'-TRIPHOSPHATE
A,B,C,D,E,F1LVC0.75
MGQ7-BENZYL GUANINE MONOPHOSPHATEA,E2V8X0.78
GSSA1AP10.79
FEG5'-O-[(S)-{[2-(carboxymethyl)-6-
hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine
A3DAG0.73
FEG5'-O-[(S)-{[2-(carboxymethyl)-6-
hydroxy-3,5-dimethylpyridin-4-yl]oxy}(hydroxy)phosphoryl]guanosine
A3DAF0.73
RUN2-[(1R,3S,4S)-1-BENZYL-4-[N-(BENZYLOXYCARBONYL)-
L-VALYL]AMINO-3-PHENYLPENTYL]-4(5)-
(2-METHYLPROPIONYL)IMIDAZOLE
B1HPS0.72
CF22'-deoxy-5'-O-{[2-(7,8-dimethyl-
2,4-dioxo-3,4-dihydrobenzo[g]pteridin-
10(2H)-yl)ethyl]carbamoyl}guanosine
A2VKF0.71
FR61-{(1R,2S)-2-HYDROXY-1-[2-(1-NAPHTHYL)ETHYL]PROPYL}-
1H-IMIDAZOLE-4-CARBOXAMIDE
A2E1W0.71
PD8PHOSPHORYLATED DIHYDROPTEROATEA1W780.71
NGDA,B2O3U0.73
4RB4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-
b]pyridazin-3-yl)benzoic acid
A3BQR0.7
8FGN-(5'-PHOSPHO-2'-DEOXYGUANOSIN-
8-YL)-2-ACETYLAMINOFLUORENE
A,C,D1X9M0.7
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B2ALY0.7
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B1VBM0.7
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B1VBN0.7
YSA5'-O-[N-(L-TYROSYL)SULFAMOYL]ADENOSINEA,B2PID0.7
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
A2R9C0.76
00A5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosineX3CW80.74
FRC1-{(1R,2S)-2-HYDROXY-1-[2-(2-NAPHTHYLOXY)ETHYL]PROPYL}-
1H-IMIDAZONE-4-CARBOXAMIDE
A1V7A0.72
ONAA,C2GVZ0.77
AGNA1GNP0.83