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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00019526

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.8
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9A0.73
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9B0.73
P1RPYRIMIDINEX2GTF0.89
LG3PYRIMIDINE-2,4-DIAMINEA2EUN0.86
LGAPYRIMIDIN-2-AMINEA2JJC0.87
5724-[2-(HYDROXYMETHYL)PYRIMIDIN-4-
YL]-N,N-DIMETHYLPIPERAZINE-1-SULFONAMIDE
A,B,C,D1PL60.81
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1JXI0.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B1TO90.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2Q4X0.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B3EPM0.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D1YAK0.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B,C,D2GM80.7
HMH4-AMINO-5-HYDROXYMETHYL-2-METHYLPYRIMIDINEA,B2F2G0.7
2BP9H-purin-2-amineA3G4M0.7
YF45-{[ETHYL(METHYL)AMINO]METHYL}-
2-METHYL-5,6-DIHYDROPYRIMIDIN-4-
AMINE
A,B1T9A0.8
3AYPYRIMIDINE-2,4,6-TRIAMINEA2G9C0.73
3AYPYRIMIDINE-2,4,6-TRIAMINEX2RBX0.73
MXD6-PIPERIDIN-1-YLPYRIMIDINE-2,4-
DIAMINE 3-OXIDE
A,B3B6H0.75
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
A,B1T9B0.8
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
I1E800.8
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.8