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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03539677

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CBQ[(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO-
METHYL]-PHOSPHONIC ACID
A,B1T1S0.7
26DPYRIDINE-2,6-DIAMINEA2ANZ0.84
DA1PYRIDINE-2,5-DIAMINEA2AQD0.77
1BY[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-
DIYL]BIS(PHOSPHONIC ACID)
A,B2I190.76
3MP3-METHYLPYRIDINEA1EUB0.7
3MP3-METHYLPYRIDINEA1BM60.7
LG45-METHYLPYRIDIN-2-AMINEA2EUP0.78
2AP2-AMINOPYRIDINEA1AEO0.77
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.71
NTNISONICOTINAMIDINEA7ADH0.72
JI2N-{(3S,4S)-4-[(6-aminopyridin-2-
yl)methyl]pyrrolidin-3-yl}ethane-
1,2-diamine
A,B3B3N0.73
JI2N-{(3S,4S)-4-[(6-aminopyridin-2-
yl)methyl]pyrrolidin-3-yl}ethane-
1,2-diamine
A,B3DQR0.73
1SQISOQUINOLIN-1-AMINEA2OHK0.73
C4CN-(4-chlorobenzyl)-N',N'-dimethyl-
N-pyridin-2-ylethane-1,2-diamine
A2RA70.72
2AQQUINOLIN-2-AMINEA2OHL0.71
MPIIMIDAZO[1,2-A]PYRIDINEA1AEM0.7
2862-ethenyl-1-methylpyridiniumX2RC20.72
AS34-METHYL-6-PROPYLPYRIDIN-2-AMINEA,B3E6N0.74
RW14-phenylpyrimidineA,B,C3B9S0.71
BVF4-METHYLPYRIDIN-2-AMINEA,B3E670.77
BVF4-METHYLPYRIDIN-2-AMINEA2EUT0.77