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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02828495

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TBN'2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-HYDROXYMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B,C1PR50.81
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL
A,B2ZOQ0.75
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL
A2VUW0.75
5ID(2R,3R,4S,5R)-2-(4-AMINO-5-IODO-
7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-
5-(HYDROXYMETHYL)TETRAHYDROFURAN-
3,4-DIOL
A,B,C,D2C470.75
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1JXI0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1TO90.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2Q4X0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B3EPM0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D1YAK0.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D2GM80.71
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2F2G0.71
7DA7-DEAZA-2'-DEOXYADENOSINE-5'-MONOPHOSPHATEB1U1K0.79
C4EN-phenyl-1H-pyrrolo[2,3-b]pyridin-
3-amine
A,B,C,D3C4E0.7
GVH1H-PYRROLO[2,3-B]PYRIDINEA2UVX0.72
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B2QTG0.78
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A,B1NC10.78
MTH2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-
7-YL)-5-METHYLSULFANYLMETHYL-TETRAHYDRO-
FURAN-3,4-DIOL
A1SD20.78
2181-[(4-AMINO-2-METHYLPYRIMIDIN-5-
YL)METHYL]-3-(2-HYDROXYETHYL)-2-
METHYLPYRIDINIUM
A2HOP0.71
5I57-(5-DEOXY-BETA-D-RIBOFURANOSYL)-
5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN-
4-AMINE
A,B,C,D2I6A0.77
MI13-{(3R,4R)-4-methyl-3-[methyl(7H-
pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-
1-yl}-3-oxopropanenitrile
A,B3FUP0.74
MI13-{(3R,4R)-4-methyl-3-[methyl(7H-
pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-
1-yl}-3-oxopropanenitrile
A3EYG0.74