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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02456854

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LG45-METHYLPYRIDIN-2-AMINEA2EUP0.73
HDT4-[(4-IMIDAZO[1,2-A]PYRIDIN-3-YLPYRIMIDIN-
2-YL)AMINO]BENZENESULFONAMIDE
A1OIT0.71
HDUN-[4-(2-METHYLIMIDAZO[1,2-A]PYRIDIN-
3-YL)-2-PYRIMIDINYL]ACETAMIDE
A1OIQ0.75
L0D2-(1H-pyrazol-3-yl)-1H-benzimidazoleA2W1D0.7
MPIIMIDAZO[1,2-A]PYRIDINEA1AEM0.88
4AP4-AMINOPYRIDINEA1AEG0.71
SB64-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL-
5-(4-PYRIDYL)-IMIDAZOLE
A1BL60.75
DA1PYRIDINE-2,5-DIAMINEA2AQD0.78
IM4(2E)-1-[(6-chloropyridin-3-yl)methyl]-
N-nitroimidazolidin-2-imine
A,C,D,E2ZJU0.7
IM4(2E)-1-[(6-chloropyridin-3-yl)methyl]-
N-nitroimidazolidin-2-imine
A,B,C,D3C790.7
2755-amino-1,2-dimethylpyridiniumX2RBW0.72
JNFN-cyclohexyl-4-imidazo[1,2-a]pyridin-
3-yl-N-methylpyrimidin-2-amine
A3CGF0.74
DMD5,6-DIMETHYLBENZIMIDAZOLEA1D0S0.71
OWLN-1H-imidazol-2-yl-N'-[4-(1H-imidazol-
2-ylamino)phenyl]benzene-1,4-diamine
A,G3FSI0.77
RBUA,B1BEX0.73
EMUN-BENZYL-9H-PURIN-6-AMINEA1W1S0.7
55FN-[4-(5-fluoro-6-methylpyridin-
2-yl)-5-quinoxalin-6-yl-1H-imidazol-
2-yl]acetamide
A,B,C,D,E3FAA0.7
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.73
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
PB21-(biphenyl-4-ylmethyl)-1H-imidazoleA,B,C,D3G930.7
PB21-(biphenyl-4-ylmethyl)-1H-imidazoleA,B,C,D3G5N0.7
SCW3-bromo-6-phenyl-N-(pyrimidin-5-
ylmethyl)imidazo[1,2-a]pyridin-
8-amine
A2R3L0.75
LI8N-(3-{[5-BROMO-2-({3-[(PYRROLIDIN-
1-YLCARBONYL)AMINO]PHENYL}AMINO)PYRIMIDIN-
4-YL]AMINO}PROPYL)-2,2-DIMETHYLMALONAMIDE
A1Z5M0.7
SB44-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-
5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE
A1BL70.73
SB44-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-
5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE
A3ERK0.73
1CI1-(4-CHLOROPHENYL)-1H-IMIDAZOLEA,B,C,D,E,F,G2Q6N0.76
RW14-phenylpyrimidineA,B,C3B9S0.7
L234-[1-(2,6-dichlorobenzyl)-2-methyl-
1H-imidazol-4-yl]pyrimidin-2-amine
A,C2W710.72
JNO2-{4-[(4-imidazo[1,2-a]pyridin-
3-ylpyrimidin-2-yl)amino]piperidin-
1-yl}-N-methylacetamide
A3CGO0.71
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.7
APY2-AMINOMETHYL-PYRIDINEI1IVP0.7
PIQ2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-
B]PYRIDINE
A,B2QXM0.75
PIQ2-AMINO-1-METHYL-6-PHENYLIMIDAZO[4,5-
B]PYRIDINE
A1HZ00.75
9DA9-DEAZAADENINEA1L1R0.8
9DA9-DEAZAADENINEA1L1Q0.8
GIQ3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-
2-AMINE
A2Z2G0.72
GIQ3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-
2-AMINE
A2Z2H0.72
GIQ3-METHYL-3H-IMIDAZO[4,5-F]QUINOLIN-
2-AMINE
A2HKC0.72
NTNISONICOTINAMIDINEA7ADH0.72
GVH1H-PYRROLO[2,3-B]PYRIDINEA2UVX0.78
SB54-(FLUOROPHENYL)-1-CYCLOPROPYLMETHYL-
5-(2-AMINO-4-PYRIMIDINYL)IMIDAZOLE
A1BMK0.74
3AP3-AMINOPYRIDINEA1AEF0.76
FRV4-{[4-(1-CYCLOPROPYL-2-METHYL-1H-
IMIDAZOL-5-YL)PYRIMIDIN-2-YL]AMINO}-
N-METHYLBENZENESULFONAMIDE
A2W060.7
1BN1-BENZYL-1H-IMIDAZOLEA,B2AFX0.74
2AP2-AMINOPYRIDINEA1AEO0.8
KSLN-(2,6-dimethylphenyl)-5-phenylimidazo[1,5-
a]pyrazin-8-amine
A2ZYB0.72
ABI5-AMIDINO-BENZIMIDAZOLEA1C2K0.73
SCE3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2-
a]pyrazin-8-amine
A2R3H0.79
2781-(1-methyl-1H-pyrrol-2-yl)methanamineX2RBV0.7
STS2-[(1S)-1-BENZYL-2-SULFANYLETHYL]-
1H-IMIDAZO[4,5-C]PYRIDIN-5-IUM
A1Y8J0.73
5MB5-METHYLBENZIMIDAZOLEA1JHM0.73
BZIBENZIMIDAZOLEA1RYC0.78
BZIBENZIMIDAZOLEA1L5F0.78
BZIBENZIMIDAZOLEA1KXM0.78
C4EN-phenyl-1H-pyrrolo[2,3-b]pyridin-
3-amine
A,B,C,D3C4E0.76
SC96-(2-fluorophenyl)-N-(pyridin-3-
ylmethyl)imidazo[1,2-a]pyrazin-
8-amine
A2R3G0.76
BVF4-METHYLPYRIDIN-2-AMINEA,B3E670.72
BVF4-METHYLPYRIDIN-2-AMINEA2EUT0.72
1BY[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-
DIYL]BIS(PHOSPHONIC ACID)
A,B2I190.72
CPZ4-(4-CHLOROPHENYL)IMIDAZOLEA1SUO0.75