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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00560221

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
XIFPIPERIDINE-3,4-DIOLA1V0L0.8
XIFPIPERIDINE-3,4-DIOLA1V0N0.8
XIFPIPERIDINE-3,4-DIOLA1FH80.8
PTOPSEUDOTROPINEA,B2AE20.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.71
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.71
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.76
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.76
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.76
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.76
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.76
NOJ1-DEOXYNOJIRIMYCINA,B2J770.76
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.76
NOJ1-DEOXYNOJIRIMYCINA3GBE0.76
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.76
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.76
NOJ1-DEOXYNOJIRIMYCINA1DOG0.76
NOJ1-DEOXYNOJIRIMYCINA,B1I750.76
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.76
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.85
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.79
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.79
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.79
IMRIMINORIBITOLA,B,C1I800.7
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.7
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.71