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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021713

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AS34-METHYL-6-PROPYLPYRIDIN-2-AMINEA,B3E6N0.76
LG45-METHYLPYRIDIN-2-AMINEA2EUP0.75
4AP4-AMINOPYRIDINEA1AEG0.71
NTNISONICOTINAMIDINEA7ADH0.71
JI3N-{(3S,4S)-4-[(6-AMINO-4-METHYLPYRIDIN-
2-YL)METHYL]PYRROLIDIN-3-YL}-N'-
(4-CHLOROBENZYL)ETHANE-1,2-DIAMINE
A,B3B3O0.7
JI3N-{(3S,4S)-4-[(6-AMINO-4-METHYLPYRIDIN-
2-YL)METHYL]PYRROLIDIN-3-YL}-N'-
(4-CHLOROBENZYL)ETHANE-1,2-DIAMINE
A,B3DQS0.7
VGD6-chloro-1H-benzimidazol-2-amineA,B,C,D2WD70.72
CBQ[(5-CHLORO-PYRIDIN-2-YLAMINO)-PHOSPHONO-
METHYL]-PHOSPHONIC ACID
A,B1T1S0.75
BVF4-METHYLPYRIDIN-2-AMINEA,B3E670.76
BVF4-METHYLPYRIDIN-2-AMINEA2EUT0.76
JI7N-{(3R,4S)-4-[(6-amino-4-methylpyridin-
2-yl)methyl]pyrrolidin-3-yl}-N'-
(3-chlorobenzyl)ethane-1,2-diamine
A,B3B3P0.7
JI7N-{(3R,4S)-4-[(6-amino-4-methylpyridin-
2-yl)methyl]pyrrolidin-3-yl}-N'-
(3-chlorobenzyl)ethane-1,2-diamine
A,B3DQT0.7
DA1PYRIDINE-2,5-DIAMINEA2AQD0.75
2451-(2-chloropyridin-4-yl)-3-phenylureaA2QKN0.71
2AP2-AMINOPYRIDINEA1AEO0.83
2AQQUINOLIN-2-AMINEA2OHL0.71
MPIIMIDAZO[1,2-A]PYRIDINEA1AEM0.7
1BY[2-(PYRIDIN-2-YLAMINO)ETHANE-1,1-
DIYL]BIS(PHOSPHONIC ACID)
A,B2I190.7
26DPYRIDINE-2,6-DIAMINEA2ANZ0.87