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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02497887

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AOG4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R820.8
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA2TOB0.74
TOC2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSEA1TOB0.74
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.81
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.81
OPMO1-PENTYL-MANNOSEA,B3GXY0.71
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B146D0.7
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B207D0.7
MDA2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDEA,B1BP80.7
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D1YQ30.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1LZI0.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,N,O,P,Q,R,
S,T
1PP90.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B2GMH0.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,O,P,Q,R,S,T
1PPJ0.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1WT10.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1WT30.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A1LZJ0.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,E,F,
G,I,N,O,P,Q,
R,S,T,U,V,W
2A060.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,N,O,
P,Q
2FBW0.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D1YQ40.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D2H890.71
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL
A,B,C,D,N,O,
P,Q
2H880.71
BNGB-NONYLGLUCOSIDEA3B440.71
BNGB-NONYLGLUCOSIDEA,B2QKS0.71
BNGB-NONYLGLUCOSIDEA1J4N0.71
BNGB-NONYLGLUCOSIDEA,B,C,D,E,F,
G,H,I,J
1RWT0.71
BNGB-NONYLGLUCOSIDEA,B1XME0.71
BNGB-NONYLGLUCOSIDEA,B1L9H0.71
BNGB-NONYLGLUCOSIDEB1LPA0.71
BNGB-NONYLGLUCOSIDEA3B450.71
BNGB-NONYLGLUCOSIDEA1YMG0.71
BNGB-NONYLGLUCOSIDEA2IC80.71
BNGB-NONYLGLUCOSIDEA,B1HZX0.71
BNGB-NONYLGLUCOSIDEA,B,C3EH40.71
BNGB-NONYLGLUCOSIDEA2O7L0.71
BNGB-NONYLGLUCOSIDEA,B1VGO0.71
BNGB-NONYLGLUCOSIDEA,B1EHK0.71
BNGB-NONYLGLUCOSIDEA,B,C3EH50.71
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.7
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.7
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.7
TOA3-DEOXY-3-AMINO GLUCOSEA1TOB0.74
TOA3-DEOXY-3-AMINO GLUCOSEA2TOB0.74
DEGBUTYL ALPHA-D-MANNOPYRANOSIDEA1UWF0.71
DEGBUTYL ALPHA-D-MANNOPYRANOSIDEA,B1TR70.71
HSGoctyl alpha-L-altropyranosideA2O9D0.71
H1Mmethyl 2-deoxy-2-(2-hydroxyethyl)-
alpha-D-mannopyranoside
A,B,C,D3D4K0.76
GDA4-DEOXY-4-AMINO-BETA-D-GLUCOSEA,B1OCB0.72
MYGGLUCOSAMINYL-(ALPHA-6)-D-MYO-INOSITOLA1GYM0.72
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1WT20.71
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1R7T0.71
DLGHEXYL 3-DEOXY-BETA-D-GALACTOPYRANOSEA1R7U0.71
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.7
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.7
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.7
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA2PIK0.74
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA6CGT0.74
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA,B1PIK0.74
HSHoctyl beta-D-galactopyranosideA2O9D0.71
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B1Y0S0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2B500.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2ZNP0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2AWH0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2ZNQ0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA3GZ90.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,D1QPF0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2BAW0.72
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2F4S0.7
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
A,B2FCX0.7
XXX(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-
4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-
5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-
2H-PYRAN-3,4-DIOL
B2ET80.7
BOGB-OCTYLGLUCOSIDEA,B3E6L0.71
BOGB-OCTYLGLUCOSIDEA,B2RCU0.71
BOGB-OCTYLGLUCOSIDEA,B3GJC0.71
BOGB-OCTYLGLUCOSIDEA2QJU0.71
BOGB-OCTYLGLUCOSIDEA,B2DEB0.71
BOGB-OCTYLGLUCOSIDEA,B1EQG0.71
BOGB-OCTYLGLUCOSIDEA,B1LPB0.71
BOGB-OCTYLGLUCOSIDEA1IGX0.71
BOGB-OCTYLGLUCOSIDEA,B1M8D0.71
BOGB-OCTYLGLUCOSIDEA,B3E680.71
BOGB-OCTYLGLUCOSIDEA1AUA0.71
BOGB-OCTYLGLUCOSIDEA,B1K8Q0.71
BOGB-OCTYLGLUCOSIDEA2CMB0.71
BOGB-OCTYLGLUCOSIDEA2JAG0.71
BOGB-OCTYLGLUCOSIDEA,B3B6H0.71
BOGB-OCTYLGLUCOSIDEA1FX80.71
BOGB-OCTYLGLUCOSIDEA1C4O0.71
BOGB-OCTYLGLUCOSIDEA2EVU0.71
BOGB-OCTYLGLUCOSIDEA,B,C,D1LRT0.71
BOGB-OCTYLGLUCOSIDEA1ZYJ0.71
BOGB-OCTYLGLUCOSIDEA1ILZ0.71
BOGB-OCTYLGLUCOSIDEA1IM00.71
BOGB-OCTYLGLUCOSIDEA1W6K0.71
BOGB-OCTYLGLUCOSIDEA1D2M0.71
BOGB-OCTYLGLUCOSIDEX2FGQ0.71
BOGB-OCTYLGLUCOSIDEX2FSM0.71
BOGB-OCTYLGLUCOSIDEA2PV50.71
BOGB-OCTYLGLUCOSIDEA,B,C,D1PXX0.71
BOGB-OCTYLGLUCOSIDEA1FE20.71
BOGB-OCTYLGLUCOSIDEA3GD80.71
BOGB-OCTYLGLUCOSIDEA1U7G0.71
BOGB-OCTYLGLUCOSIDEA,B1Q4G0.71
BOGB-OCTYLGLUCOSIDEA3C020.71
BOGB-OCTYLGLUCOSIDEA2PTO0.71
BOGB-OCTYLGLUCOSIDEA,D1B4W0.71
BOGB-OCTYLGLUCOSIDEA,B1ECZ0.71
BOGB-OCTYLGLUCOSIDEA,B,C,D1C1J0.71
BOGB-OCTYLGLUCOSIDEA,B2R4J0.71
BOGB-OCTYLGLUCOSIDEA3B9Y0.71
BOGB-OCTYLGLUCOSIDEA2QB40.71
BOGB-OCTYLGLUCOSIDEA2QEI0.71
BOGB-OCTYLGLUCOSIDEA,B2QCU0.71
BOGB-OCTYLGLUCOSIDEA,B1Q7T0.71
BOGB-OCTYLGLUCOSIDEA,C,D,E,N,P,
Q,R
3H1H0.71
BOGB-OCTYLGLUCOSIDEA,C,D,E,N,P,
Q,R
3H1K0.71
BOGB-OCTYLGLUCOSIDEA,B2R450.71
BOGB-OCTYLGLUCOSIDEA,B,C,D,E,F1NKZ0.71
BOGB-OCTYLGLUCOSIDEA1W6J0.71
BOGB-OCTYLGLUCOSIDEX2FSL0.71
BOGB-OCTYLGLUCOSIDEA1QD50.71
BOGB-OCTYLGLUCOSIDEA,B,D,F,G,H,I1JMU0.71
BOGB-OCTYLGLUCOSIDEC,D,E1BCC0.71
BOGB-OCTYLGLUCOSIDEA,B2Z730.71
BOGB-OCTYLGLUCOSIDEA,B2R4E0.71
BOGB-OCTYLGLUCOSIDEA3B9W0.71
BOGB-OCTYLGLUCOSIDEC,D,E2BCC0.71
BOGB-OCTYLGLUCOSIDEA1IGZ0.71
BOGB-OCTYLGLUCOSIDEA2F950.71
BOGB-OCTYLGLUCOSIDEA1LDA0.71
BOGB-OCTYLGLUCOSIDEA3BIF0.71
BOGB-OCTYLGLUCOSIDEA,B1CQE0.71
BOGB-OCTYLGLUCOSIDEA,B1JWK0.71
BOGB-OCTYLGLUCOSIDEA1JGJ0.71
BOGB-OCTYLGLUCOSIDEA3F3A0.71
BOGB-OCTYLGLUCOSIDEA2GQ80.71
BOGB-OCTYLGLUCOSIDEA1H2S0.71
BOGB-OCTYLGLUCOSIDEA3F4I0.71
BOGB-OCTYLGLUCOSIDEA,B,C,D1DDX0.71
BOGB-OCTYLGLUCOSIDEA,D1M2Z0.71
BOGB-OCTYLGLUCOSIDEX2FST0.71
BOGB-OCTYLGLUCOSIDEA1XEZ0.71
BOGB-OCTYLGLUCOSIDEA3F4J0.71
BOGB-OCTYLGLUCOSIDEA,B2NS10.71
BOGB-OCTYLGLUCOSIDEA1ILD0.71
BOGB-OCTYLGLUCOSIDED,E,G1YK30.71
BOGB-OCTYLGLUCOSIDEP2OYU0.71
BOGB-OCTYLGLUCOSIDEA,B,C,D,E,F,
G,H
3BKD0.71
BOGB-OCTYLGLUCOSIDEA3F3D0.71
BOGB-OCTYLGLUCOSIDEA2PTJ0.71
BOGB-OCTYLGLUCOSIDEA,B1OKE0.71
BOGB-OCTYLGLUCOSIDEA1NF80.71
BOGB-OCTYLGLUCOSIDEA2P4B0.71
BOGB-OCTYLGLUCOSIDEA,B1M9T0.71
BOGB-OCTYLGLUCOSIDEA2PKJ0.71
BOGB-OCTYLGLUCOSIDEL,M4RCR0.71
BOGB-OCTYLGLUCOSIDEA,B2R460.71
BOGB-OCTYLGLUCOSIDEA,B1HT50.71
BOGB-OCTYLGLUCOSIDEA,B2IWW0.71
BOGB-OCTYLGLUCOSIDEA2Q720.71
BOGB-OCTYLGLUCOSIDEA,B,C,D,E,F1IJD0.71
BOGB-OCTYLGLUCOSIDEA1ZZ20.71
BOGB-OCTYLGLUCOSIDEA2CMC0.71
BOGB-OCTYLGLUCOSIDEA,C,D,E,G,P,
Q,R,W
3CWB0.71
BOGB-OCTYLGLUCOSIDEA,B2BIF0.71
BOGB-OCTYLGLUCOSIDEA1LDI0.71
BOGB-OCTYLGLUCOSIDEA2A650.71
BOGB-OCTYLGLUCOSIDEA2O9G0.71
BOGB-OCTYLGLUCOSIDEA2JAF0.71
BOGB-OCTYLGLUCOSIDEA2PV80.71
BOGB-OCTYLGLUCOSIDEA3F480.71
BOGB-OCTYLGLUCOSIDEA,B1TCB0.71
BOGB-OCTYLGLUCOSIDEA,B,C,D2CZV0.71
BOGB-OCTYLGLUCOSIDEA,B1HT80.71
BOGB-OCTYLGLUCOSIDEA3DQB0.71
BOGB-OCTYLGLUCOSIDEP2OYE0.71
BOGB-OCTYLGLUCOSIDEA1DIY0.71
BOGB-OCTYLGLUCOSIDEA,B2AYL0.71
BOGB-OCTYLGLUCOSIDEA3F3E0.71
BOGB-OCTYLGLUCOSIDEA,B1VE60.71
BOGB-OCTYLGLUCOSIDEA2Q6H0.71
BOGB-OCTYLGLUCOSIDEA,B1I780.71
BOGB-OCTYLGLUCOSIDEA,B1PGE0.71
BOGB-OCTYLGLUCOSIDEA1P490.71
BOGB-OCTYLGLUCOSIDEA3GJD0.71
BOGB-OCTYLGLUCOSIDEA,B1PTH0.71
BOGB-OCTYLGLUCOSIDEA,B1CVU0.71
BOGB-OCTYLGLUCOSIDEA2GOU0.71
BOGB-OCTYLGLUCOSIDEA,B2OXL0.71
BOGB-OCTYLGLUCOSIDEA2CNE0.71
BOGB-OCTYLGLUCOSIDEA1NF90.71
BOGB-OCTYLGLUCOSIDEA,B1TCC0.71
BOGB-OCTYLGLUCOSIDEA1YC90.71
BOGB-OCTYLGLUCOSIDE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,P,Q,
S,T,U,W,X,Y,Z
1L6L0.71
BOGB-OCTYLGLUCOSIDEA,B1UUM0.71
BOGB-OCTYLGLUCOSIDEA,B1YZ40.71
BOGB-OCTYLGLUCOSIDEA1U670.71
BOGB-OCTYLGLUCOSIDEA3F3C0.71
BOGB-OCTYLGLUCOSIDEA,B1JWJ0.71
BOGB-OCTYLGLUCOSIDEX2FSO0.71
BOGB-OCTYLGLUCOSIDEA,B,C,F,H,I,
J,K
2HD00.71
BOGB-OCTYLGLUCOSIDEA1LDF0.71
BOGB-OCTYLGLUCOSIDEA2AA20.71
BOGB-OCTYLGLUCOSIDEA,B,C,D,E,F2G3N0.71
BOGB-OCTYLGLUCOSIDEA,B1EQH0.71
BOGB-OCTYLGLUCOSIDEA3B9Z0.71
BOGB-OCTYLGLUCOSIDEA2F930.71
BOGB-OCTYLGLUCOSIDEA2NPQ0.71
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ90.74
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ40.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.74
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.74
0BD3-methyl-1-(2-methylpropyl)butyl 4-
O-beta-L-gulopyranosyl-beta-D-glucopyranoside
A,B3FQQ0.7