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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02845242

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IM92-{4-[4-({4-[2-methyl-1-(1-methylethyl)-
1H-imidazol-5-yl]pyrimidin-2-yl}amino)phenyl]piperazin-
1-yl}-2-oxoethanol
A2VV90.72
G142-phenyl-1H-imidazole-4-carboxylic acidA,B3GRJ0.71
9DA9-DEAZAADENINEA1L1R0.75
9DA9-DEAZAADENINEA1L1Q0.75
GVH1H-PYRROLO[2,3-B]PYRIDINEA2UVX0.71
C4EN-phenyl-1H-pyrrolo[2,3-b]pyridin-
3-amine
A,B,C,D3C4E0.75
AD5N~6~-cyclohexyl-N~2~-(4-morpholin-
4-ylphenyl)-9H-purine-2,6-diamine
A,B2VGO0.73
LZ44-[(6-chloropyrazin-2-yl)amino]benzenesulfonamideA2VTJ0.7
NHV(5R,6R,7S,8R)-6,7,8-trihydroxy-
5-(hydroxymethyl)-2-[(phenylamino)methyl]-
5,6,7,8-tetrahydro-1H-imidazo[1,2-
a]pyridin-4-ium
A,B2VOT0.76
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.72
IDE(5R,6R,7S,8S)-3-(ANILINOMETHYL)-
5,6,7,8-TETRAHYDRO-5-(HYDROXYMETHYL)-
IMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL
A1X390.74
IDE(5R,6R,7S,8S)-3-(ANILINOMETHYL)-
5,6,7,8-TETRAHYDRO-5-(HYDROXYMETHYL)-
IMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL
A,B2J7C0.74
1CI1-(4-CHLOROPHENYL)-1H-IMIDAZOLEA,B,C,D,E,F,G2Q6N0.79
SCE3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-
a]pyrazin-8-amine
A2R3H0.73
55FN-[4-(5-fluoro-6-methylpyridin-
2-yl)-5-quinoxalin-6-yl-1H-imidazol-
2-yl]acetamide
A,B,C,D,E3FAA0.7
PIM4-PHENYL-1H-IMIDAZOLEA,B2D0T0.79
PIM4-PHENYL-1H-IMIDAZOLEA1E9X0.79
PIM4-PHENYL-1H-IMIDAZOLEA1PHD0.79
PIM4-PHENYL-1H-IMIDAZOLEA,B,C,D2RFC0.79
PIM4-PHENYL-1H-IMIDAZOLEA1ODO0.79
PIM4-PHENYL-1H-IMIDAZOLEA3E5K0.79
PIM4-PHENYL-1H-IMIDAZOLEA1PHE0.79
PIM4-PHENYL-1H-IMIDAZOLEA,B1F4T0.79
PIM4-PHENYL-1H-IMIDAZOLEA1S1F0.79
PIM4-PHENYL-1H-IMIDAZOLEA1PHF0.79
2AP2-AMINOPYRIDINEA1AEO0.7
HBNN-(2-NAPHTHYL)HISTIDINAMIDEB1VEA0.71
OLP2-(2-HYDROXYETHYLAMINO)-6-(3-CHLOROANILINO)-
9-ISOPROPYLPURINE
A,B,C,D3BPR0.71
OLP2-(2-HYDROXYETHYLAMINO)-6-(3-CHLOROANILINO)-
9-ISOPROPYLPURINE
A2CMW0.71
HDUN-[4-(2-METHYLIMIDAZO[1,2-A]PYRIDIN-
3-YL)-2-PYRIMIDINYL]ACETAMIDE
A1OIQ0.72
OWLN-1H-imidazol-2-yl-N'-[4-(1H-imidazol-
2-ylamino)phenyl]benzene-1,4-diamine
A,G3FSI0.84
1212-(3-HYDROXY-PYRIDIN-2-YL)-1H-BENZOIMIDAZOLE-
5-CARBOXAMIDINE
H,I,L1GHY0.72
8012-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-
2-YL}PYRIDIN-3-OLATE
A1O340.74
8012-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-
2-YL}PYRIDIN-3-OLATE
A1O310.74
8012-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-
2-YL}PYRIDIN-3-OLATE
A1O330.74
8012-{5-[AMINO(IMINIO)METHYL]-1H-BENZIMIDAZOL-
2-YL}PYRIDIN-3-OLATE
A1O320.74
1BN1-BENZYL-1H-IMIDAZOLEA,B2AFX0.75
DMD5,6-DIMETHYLBENZIMIDAZOLEA1D0S0.72
ABI5-AMIDINO-BENZIMIDAZOLEA1C2K0.74
L0D2-(1H-pyrazol-3-yl)-1H-benzimidazoleA2W1D0.71
STS2-[(1S)-1-BENZYL-2-SULFANYLETHYL]-
1H-IMIDAZO[4,5-C]PYRIDIN-5-IUM
A1Y8J0.72
DA1PYRIDINE-2,5-DIAMINEA2AQD0.71
FRV4-{[4-(1-CYCLOPROPYL-2-METHYL-1H-
IMIDAZOL-5-YL)PYRIMIDIN-2-YL]AMINO}-
N-METHYLBENZENESULFONAMIDE
A2W060.7
MPIIMIDAZO[1,2-A]PYRIDINEA1AEM0.78
SB44-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-
5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE
A1BL70.71
SB44-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-
5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE
A3ERK0.71
FRTN-(2-METHOXYETHYL)-4-({4-[2-METHYL-
1-(1-METHYLETHYL)-1H-IMIDAZOL-5-
YL]PYRIMIDIN-2-YL}AMINO)BENZENESULFONAMIDE
A2W050.72
KSLN-(2,6-dimethylphenyl)-5-phenylimidazo[1,5-
a]pyrazin-8-amine
A2ZYB0.72
PIQ2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-
B]PYRIDINE
A,B2QXM0.71
PIQ2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-
B]PYRIDINE
A1HZ00.71
CPZ4-(4-CHLOROPHENYL)IMIDAZOLEA1SUO0.74
MSR4-(1H-IMIDAZOL-1-YL)PHENOLA2ORQ0.77
N31N-[3-(1H-benzimidazol-1-yl)propanoyl]glycyl-
L-alanyl-L-alaninamide
A3EXB0.72
PB21-(biphenyl-4-ylmethyl)-1H-imidazoleA,B,C,D3G930.71
PB21-(biphenyl-4-ylmethyl)-1H-imidazoleA,B,C,D3G5N0.71
BZIBENZIMIDAZOLEA1RYC0.78
BZIBENZIMIDAZOLEA1L5F0.78
BZIBENZIMIDAZOLEA1KXM0.78
TRM1H-BENOXIMIDAZOLE-2-CARBOXYLIC ACIDA1FQ40.72
SC96-(2-fluorophenyl)-N-(pyridin-3-
ylmethyl)imidazo[1,2-a]pyrazin-
8-amine
A2R3G0.71
SB64-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-
5-(4-PYRIDYL)-IMIDAZOLE
A1BL60.71
5MB5-METHYLBENZIMIDAZOLEA1JHM0.74