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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02255181

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1HRN0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA1EAG0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1BIM0.7
CHA1-HYDROXY-2-AMINO-3-CYCLOHEXYLPROPANEA,B1BIL0.7
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVM0.76
2AO(2S)-2-AMINOHEXAN-1-OLA,I2O400.76
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOD0.76
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AVQ0.76
2AO(2S)-2-AMINOHEXAN-1-OLA,B,C2AOC0.76
GE23,5-DIAMINO-CYCLOHEXANOLA1BYJ0.72
XDNPIPERIDINE-3,4,5-TRIOLA1V0K0.7
XDNPIPERIDINE-3,4,5-TRIOLA1V0M0.7
XDNPIPERIDINE-3,4,5-TRIOLA1FH70.7
M1C(3S)-3-AMINO-1-(CYCLOPROPYLAMINO)HEPTANE-
2,2-DIOL
A1QXW0.75
AHS(3-AMINO-4-CYCLOHEXYL-2-HYDROXY-
BUTYL)-ISOBUTYL-CARBAMIC ACID
I5ER20.72
EMP2,4-DIDEOXY-4-(ETHYLAMINO)-3-O-
METHYL ALPHA-L-THREO-PENTOPYRANOSIDE
A2PIK0.73
IMRIMINORIBITOLA,B,C1I800.71
MMN5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-
D-GLUCITOL
A1XUZ0.75
1AB1,4-DIDEOXY-1,4-IMINO-D-ARABINITOLA2G9Q0.71
MAT2,4-DIDEOXY-4-[2-(PROPYL)AMINO]-
3-O-METHYL ALPHA-L-THREO-PENTOPYRANOSIDE
A,B1PIK0.73
DFU(2S,3R,4S,5R)-2-METHYLPIPERIDINE-
3,4,5-TRIOL
A,B2EAC0.79
LCXCARBOXYLATED LYSINEA,B2OB30.71
LCXCARBOXYLATED LYSINEA3C860.71
LCXCARBOXYLATED LYSINEA2ICS0.71
LCXCARBOXYLATED LYSINEA,B3E3H0.71
LCXCARBOXYLATED LYSINEA,B,K,P3CS20.71
LCXCARBOXYLATED LYSINEA,B,C,D,E,F2OGJ0.71
LCXCARBOXYLATED LYSINEA,B2OQL0.71
LCXCARBOXYLATED LYSINEA2GC60.71
LCXCARBOXYLATED LYSINEA,B3CAK0.71
TOB1,3-DIAMINO-5,6-DIHYDROXYCYCLOHEXANEA1TOB0.71
NOJ1-DEOXYNOJIRIMYCINA,B1OIM0.74
NOJ1-DEOXYNOJIRIMYCINA,B2J770.74
NOJ1-DEOXYNOJIRIMYCINA,B2JKE0.74
NOJ1-DEOXYNOJIRIMYCINA3GBE0.74
NOJ1-DEOXYNOJIRIMYCINA,B3GXT0.74
NOJ1-DEOXYNOJIRIMYCINA,B1DIE0.74
NOJ1-DEOXYNOJIRIMYCINA1DOG0.74
NOJ1-DEOXYNOJIRIMYCINA,B1I750.74
NOJ1-DEOXYNOJIRIMYCINA,B2PWD0.74
DQQ2,5-DIDEOXY-2,5-IMINO-D-MANNITOLA2AEY0.72
DMJ1-DEOXYMANNOJIRIMYCINA,B1KRE0.74
DMJ1-DEOXYMANNOJIRIMYCINA1FO20.74
DMJ1-DEOXYMANNOJIRIMYCINA1G6I0.74
DMJ1-DEOXYMANNOJIRIMYCINA1HXK0.74
MAIDEOXO-METHYLARGININEA,B1ORF0.7
MAIDEOXO-METHYLARGININEB,C,E,F1SFQ0.7
MAIDEOXO-METHYLARGININEL1Z8G0.7
MAIDEOXO-METHYLARGININEE,F1BQY0.7
MAIDEOXO-METHYLARGININEI,J1LMW0.7
MAIDEOXO-METHYLARGININEL,P1AUT0.7
MAIDEOXO-METHYLARGININEA,B,C,D,E,F,
G,H,J,K,L,M,
N,P,Q,R
1P8J0.7
MAIDEOXO-METHYLARGININEI1BUI0.7
MAIDEOXO-METHYLARGININEC,E,F1SHH0.7
HHO1-(HYDROXYMETHYLENEAMINO)-8-HYDROXY-
OCTANE
I,J1AY60.72
DIG2,5-DIDEOXY-2,5-IMINO-D-GLUCITOLA,B1DID0.72