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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02028404

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
301N6-(penta-2,3-dienyl)adenineA3BW70.7
EA13H-IMIDAZO[2,1-I]PURINEA,B1PU80.72
3MA6-AMINO-3-METHYLPURINEA3MAG0.7
M1A6-AMINO-1-METHYLPURINEA1B420.7
PYD2,5-DIMETHYL-PYRIMIDIN-4-YLAMINEA4THI0.78
DX36,7,7-trimethyl-7,8-dihydropteridine-
2,4-diamine
A,B,C,D3BMF0.72
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine
A,B2W6Z0.7
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.7
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A1W1Q0.74
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE
A2EXM0.74
P1RPYRIMIDINEX2GTF0.74
YF45-{[ETHYL(METHYL)AMINO]METHYL}-
2-METHYL-5,6-DIHYDROPYRIMIDIN-4-
AMINE
A,B1T9A0.78
LGAPYRIMIDIN-2-AMINEA2JJC0.75
LG3PYRIMIDINE-2,4-DIAMINEA2EUN0.8
2BP9H-purin-2-amineA3G4M0.78
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM
A,B1PU70.71
YF12,5-DIMETHYLPYRIMIDIN-4-AMINEA,B,C,D1T9D0.78
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9A0.79
YF32-{[(4-AMINO-2-METHYLPYRIMIDIN-
5-YL)METHYL]AMINO}PROPANE-1-THIOL
A,B1T9B0.79
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
A,B1T9B0.8
NSP5-(AMINOMETHYL)-2-METHYLPYRIMIDIN-
4-AMINE
I1E800.8
3AYPYRIMIDINE-2,4,6-TRIAMINEA2G9C0.7
3AYPYRIMIDINE-2,4,6-TRIAMINEX2RBX0.7
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.71
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.72