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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03729669

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.72
API2,6-DIAMINOPIMELIC ACIDA2DAP0.72
API2,6-DIAMINOPIMELIC ACIDE,S148L0.72
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.73
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.73
DOA12-AMINO-DODECANOIC ACIDA2DCX0.73
DOA12-AMINO-DODECANOIC ACIDB1EOL0.73
6CL6-CARBOXYLYSINEU2AIZ0.72
DNN7,8-DIAMINO-NONANOIC ACIDA1DAH0.78
DNN7,8-DIAMINO-NONANOIC ACIDA1A820.78
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1E800.83
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I1EED0.83
CHS4-AMINO-5-CYCLOHEXYL-3-HYDROXY-
PENTANOIC ACID
I2ER00.83
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.73
DFI2,2-DIFLUOROSTATINEE,I1APW0.79
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.8
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.75
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.8
CFS4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO-
3-HYDROXY-PENTANOIC ACID
A1FQ80.79
HC5(R)-3-CARBOXY-2-(HEXANOYLOXY)-N,N,N-
TRIMETHYLPROPAN-1-AMINIUM
A,B2H3W0.71
CHFCYCLOHEXYLFLUOROSTATONEE1EPR0.72
CHFCYCLOHEXYLFLUOROSTATONEA,B1OD10.72
CHFCYCLOHEXYLFLUOROSTATONEA,I2JXR0.72
CHFCYCLOHEXYLFLUOROSTATONEA,B2VS20.72
CHFCYCLOHEXYLFLUOROSTATONEI1EPO0.72
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJJ0.72
CHFCYCLOHEXYLFLUOROSTATONEA,B2JJI0.72
EKE(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACIDA,I2HAL0.75
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.78
CPV5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOPROPYL-HEXANOIC ACID
I1IVQ0.71
HLUBETA-HYDROXYLEUCINEA1ROV0.71
DFO2,2-DIFLUORO-3-HYDROSTATINEE,I1APV0.73
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.72
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.72
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.72
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.72
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.72
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.73