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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03335516

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
C10HEXAETHYLENE GLYCOL MONODECYL ETHERA,B2BHI0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2R8A0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2VQI0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2POR0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H350.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C2F1T0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,D,E2GR70.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA5PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2QTK0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1HXT0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFP0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQG0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA7PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEX3DWO0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H390.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2BIX0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3B0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6H0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1QJP0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2ODJ0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFO0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B3BRY0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3BRZ0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFQ0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2ZFG0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1BXW0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C2O4V0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,C1ETH0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6Q0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEX2F1C0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1BH30.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O790.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C3DZM0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B2SQC0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA8PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1O6R0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B3BS00.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1QJ80.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3A0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1MPF0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQH0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1GSZ0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQE0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1HXX0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H370.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B1T160.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1GFM0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B1GZM0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA2OMF0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1UMP0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H360.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA,B,C1H3C0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3C9L0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA6PRN0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA1NQF0.7
C8E(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANEA3POR0.7
L4P3-[GLYCEROLYLPHOSPHONYL]-[1,2-DI-
PHYTANYL]GLYCEROL
A1DZE0.72
L4P3-[GLYCEROLYLPHOSPHONYL]-[1,2-DI-
PHYTANYL]GLYCEROL
A1QM80.72
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1O0A0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A2I200.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1F4Z0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1F500.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1M0K0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1P8I0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1JV70.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1JV60.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1M0L0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1P8U0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A2I1X0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1KG80.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A2I210.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1P8H0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1C8R0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1M0M0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1MGY0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1KG90.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1S8J0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1C3W0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1KGB0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1C8S0.84
LI11-[2,6,10.14-TETRAMETHYL-HEXADECAN-
16-YL]-2-[2,10,14-TRIMETHYLHEXADECAN-
16-YL]GLYCEROL
A1S8L0.84
HNB(2S,5R)-5-pentyltetrahydrofuran-
2-ol
A2K8T0.7
HNB(2S,5R)-5-pentyltetrahydrofuran-
2-ol
A2K8U0.7
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA,B2ERV0.7
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERX1UYN0.7
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA1P4T0.7
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERX1UYO0.7
CXEPENTAETHYLENE GLYCOL MONODECYL ETHERA,B3FID0.7
HTOHEPTANE-1,2,3-TRIOLH,L,M2HH10.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWT0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXK0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M1RZH0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2HG30.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX30.73
HTOHEPTANE-1,2,3-TRIOLA2PIL0.73
HTOHEPTANE-1,2,3-TRIOLA,B1U190.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8D0.73
HTOHEPTANE-1,2,3-TRIOLA,B,C,D3DTU0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX40.73
HTOHEPTANE-1,2,3-TRIOLA,B1HZX0.73
HTOHEPTANE-1,2,3-TRIOLA,B2G870.73
HTOHEPTANE-1,2,3-TRIOLA,B2PED0.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M3D380.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWV0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M1RG50.73
HTOHEPTANE-1,2,3-TRIOLA1KMO0.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M1L9B0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWU0.73
HTOHEPTANE-1,2,3-TRIOLA1AY20.73
HTOHEPTANE-1,2,3-TRIOLA,B1RP00.73
HTOHEPTANE-1,2,3-TRIOLC,H,L,M2I5N0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2J8C0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2HJ60.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXJ0.73
HTOHEPTANE-1,2,3-TRIOLL,M1YF60.73
HTOHEPTANE-1,2,3-TRIOLB2BF30.73
HTOHEPTANE-1,2,3-TRIOLA,B2HPY0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UX50.73
HTOHEPTANE-1,2,3-TRIOLL,M,X2UXM0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UXL0.73
HTOHEPTANE-1,2,3-TRIOLA,B1L9H0.73
HTOHEPTANE-1,2,3-TRIOLA2HI20.73
HTOHEPTANE-1,2,3-TRIOLA,B,D,E,G,H,
J,K
1LGH0.73
HTOHEPTANE-1,2,3-TRIOLH,L,M2UWW0.73
DFR3-DEOXY-3-METHYL-D-FRUCTOSEA9XIA0.73
PH11,2-[DI-2,6,10,14-TETRAMETHYL-HEXADECAN-
16-OXY]-PROPANE
A1QHJ0.71
L2P2,3-DI-PHYTANYL-GLYCEROLA1QM80.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1UCQ0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA2ZFE0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA2EI40.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1IW90.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1IXF0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA,B,D,E2Z550.84
L2P2,3-DI-PHYTANYL-GLYCEROL11X0K0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1X0S0.84
L2P2,3-DI-PHYTANYL-GLYCEROL11X0I0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1DZE0.84
L2P2,3-DI-PHYTANYL-GLYCEROLA1IW60.84
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W6U0.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W160.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W760.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W780.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C,D1WDK0.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W6T0.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B2W750.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A1TV50.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B2O5P0.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C,D1WDL0.7
N8E3,6,9,12,15-PENTAOXATRICOSAN-1-
OL
A,B,C2W770.7