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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03686236

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DT3(2S,3S)-2,3-DIHYDROXY-4-SULFANYLBUTANE-
1-SULFONATE
A1YLH0.83
DTDDITHIANE DIOLA,B,C,D,E2C970.85
DTDDITHIANE DIOLA2IZX0.85
DTDDITHIANE DIOLA2VJ00.85
DTDDITHIANE DIOLA3GVO0.85
DTDDITHIANE DIOLB,I2C2Z0.85
DTDDITHIANE DIOLA,B,C,D2PVA0.85
DTDDITHIANE DIOLA,B,C1QTN0.85
DTDDITHIANE DIOLA1W800.85
DTDDITHIANE DIOLA,B1E420.85
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B2IYG0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D1O9J0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A3H9M0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3G360.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B1KZI0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A1YWM0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B1TV80.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E,F,
G,H
1W4R0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E2C920.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B2IYI0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3C610.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E1W190.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A2VK30.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C2VNF0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,D,E,F,G,
H,I
2BGC0.94
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C2H000.94
D1D(4S,5S)-1,2-DITHIANE-4,5-DIOLA,B,C,D,E1W190.85
D1D(4S,5S)-1,2-DITHIANE-4,5-DIOLA,B,C,D,E1W290.85
D1D(4S,5S)-1,2-DITHIANE-4,5-DIOLA,B2HEI0.85
D1D(4S,5S)-1,2-DITHIANE-4,5-DIOLA,B,C,D3BMM0.85
D1D(4S,5S)-1,2-DITHIANE-4,5-DIOLA,B,C,D3BMO0.85
HED2-HYDROXYETHYL DISULFIDEA1CVK0.71
HED2-HYDROXYETHYL DISULFIDEA3DMV0.71
HED2-HYDROXYETHYL DISULFIDEA1CTW0.71
HED2-HYDROXYETHYL DISULFIDEA248L0.71
HED2-HYDROXYETHYL DISULFIDEA1CV10.71
HED2-HYDROXYETHYL DISULFIDEA249L0.71
HED2-HYDROXYETHYL DISULFIDEA,B,C2Q9E0.71
HED2-HYDROXYETHYL DISULFIDEA1D3N0.71
HED2-HYDROXYETHYL DISULFIDEA3DN80.71
HED2-HYDROXYETHYL DISULFIDEA1P370.71
HED2-HYDROXYETHYL DISULFIDEA1G0M0.71
HED2-HYDROXYETHYL DISULFIDEA1QTC0.71
HED2-HYDROXYETHYL DISULFIDEA186L0.71
HED2-HYDROXYETHYL DISULFIDEA1P3N0.71
HED2-HYDROXYETHYL DISULFIDEA1QSQ0.71
HED2-HYDROXYETHYL DISULFIDEA1KS30.71
HED2-HYDROXYETHYL DISULFIDEA1I6S0.71
HED2-HYDROXYETHYL DISULFIDEA3DN00.71
HED2-HYDROXYETHYL DISULFIDEA3DN20.71
HED2-HYDROXYETHYL DISULFIDEA1LWG0.71
HED2-HYDROXYETHYL DISULFIDEA187L0.71
HED2-HYDROXYETHYL DISULFIDEA1QTB0.71
HED2-HYDROXYETHYL DISULFIDEA1CU50.71
HED2-HYDROXYETHYL DISULFIDEA3DN10.71
HED2-HYDROXYETHYL DISULFIDEA1D3F0.71
HED2-HYDROXYETHYL DISULFIDEA1G0P0.71
HED2-HYDROXYETHYL DISULFIDEA3DMZ0.71
HED2-HYDROXYETHYL DISULFIDEA1D2Y0.71
HED2-HYDROXYETHYL DISULFIDEA215L0.71
HED2-HYDROXYETHYL DISULFIDEA1QT50.71
HED2-HYDROXYETHYL DISULFIDEA252L0.71
HED2-HYDROXYETHYL DISULFIDEA1QUO0.71
HED2-HYDROXYETHYL DISULFIDEA235L0.71
HED2-HYDROXYETHYL DISULFIDEA250L0.71
HED2-HYDROXYETHYL DISULFIDEA1LW90.71
HED2-HYDROXYETHYL DISULFIDEA,B1PKW0.71
HED2-HYDROXYETHYL DISULFIDEA1CV00.71
HED2-HYDROXYETHYL DISULFIDEA3G3V0.71
HED2-HYDROXYETHYL DISULFIDEA1CV60.71
HED2-HYDROXYETHYL DISULFIDEA240L0.71
HED2-HYDROXYETHYL DISULFIDEA,B1PKZ0.71
HED2-HYDROXYETHYL DISULFIDEA241L0.71
HED2-HYDROXYETHYL DISULFIDEA1D2W0.71
HED2-HYDROXYETHYL DISULFIDEA1G0G0.71
HED2-HYDROXYETHYL DISULFIDEA1KY00.71
HED2-HYDROXYETHYL DISULFIDEA244L0.71
HED2-HYDROXYETHYL DISULFIDEA1D3J0.71
HED2-HYDROXYETHYL DISULFIDEA219L0.71
HED2-HYDROXYETHYL DISULFIDEA245L0.71
HED2-HYDROXYETHYL DISULFIDEA192L0.71
HED2-HYDROXYETHYL DISULFIDEA1P460.71
HED2-HYDROXYETHYL DISULFIDEA1G0L0.71
HED2-HYDROXYETHYL DISULFIDEA1KW50.71
HED2-HYDROXYETHYL DISULFIDEA212L0.71
HED2-HYDROXYETHYL DISULFIDEA1LWK0.71
HED2-HYDROXYETHYL DISULFIDEA1P2R0.71
HED2-HYDROXYETHYL DISULFIDEA236L0.71
HED2-HYDROXYETHYL DISULFIDEA,B2O6I0.71
HED2-HYDROXYETHYL DISULFIDEA3DNA0.71
HED2-HYDROXYETHYL DISULFIDEA1CX60.71
HED2-HYDROXYETHYL DISULFIDEA1P6Y0.71
HED2-HYDROXYETHYL DISULFIDEA246L0.71
HED2-HYDROXYETHYL DISULFIDEA1P640.71
HED2-HYDROXYETHYL DISULFIDEA1G0K0.71
HED2-HYDROXYETHYL DISULFIDEA210L0.71
HED2-HYDROXYETHYL DISULFIDEA181L0.71
HED2-HYDROXYETHYL DISULFIDEA1QUG0.71
HED2-HYDROXYETHYL DISULFIDEA182L0.71
HED2-HYDROXYETHYL DISULFIDEA1G0J0.71
HED2-HYDROXYETHYL DISULFIDEA1KY10.71
HED2-HYDROXYETHYL DISULFIDEA3DMX0.71
HED2-HYDROXYETHYL DISULFIDEA191L0.71
HED2-HYDROXYETHYL DISULFIDEA1ZYT0.71
HED2-HYDROXYETHYL DISULFIDEA1L0J0.71
HED2-HYDROXYETHYL DISULFIDEA3CDR0.71
HED2-HYDROXYETHYL DISULFIDEA3DN40.71
HED2-HYDROXYETHYL DISULFIDEA1NHB0.71
HED2-HYDROXYETHYL DISULFIDEA242L0.71
HED2-HYDROXYETHYL DISULFIDEA257L0.71
HED2-HYDROXYETHYL DISULFIDEA1QSB0.71
HED2-HYDROXYETHYL DISULFIDEA1L0K0.71
HED2-HYDROXYETHYL DISULFIDEA185L0.71
HED2-HYDROXYETHYL DISULFIDEA1P2L0.71
HED2-HYDROXYETHYL DISULFIDEA2CUU0.71
HED2-HYDROXYETHYL DISULFIDEA1QS50.71
HED2-HYDROXYETHYL DISULFIDEA1CU00.71
HED2-HYDROXYETHYL DISULFIDEA3DN60.71
HED2-HYDROXYETHYL DISULFIDEA1CV50.71
HED2-HYDROXYETHYL DISULFIDEA188L0.71
HED2-HYDROXYETHYL DISULFIDEA1CV40.71
HED2-HYDROXYETHYL DISULFIDEA3FA00.71
HED2-HYDROXYETHYL DISULFIDEA183L0.71
HED2-HYDROXYETHYL DISULFIDEA184L0.71
HED2-HYDROXYETHYL DISULFIDEA1PQJ0.71
HED2-HYDROXYETHYL DISULFIDEA2F2Q0.71
HED2-HYDROXYETHYL DISULFIDEA243L0.71
HED2-HYDROXYETHYL DISULFIDEA251L0.71
HED2-HYDROXYETHYL DISULFIDEA1CV30.71
HED2-HYDROXYETHYL DISULFIDEA1QTD0.71
HED2-HYDROXYETHYL DISULFIDEA1T8A0.71
HED2-HYDROXYETHYL DISULFIDEA1CUQ0.71
HED2-HYDROXYETHYL DISULFIDEA237L0.71
HED2-HYDROXYETHYL DISULFIDEA247L0.71
HED2-HYDROXYETHYL DISULFIDEA1KW70.71
HED2-HYDROXYETHYL DISULFIDEA1CU30.71
HED2-HYDROXYETHYL DISULFIDEA1CUP0.71
HED2-HYDROXYETHYL DISULFIDEA3F8V0.71
HED2-HYDROXYETHYL DISULFIDEA3G3W0.71
HED2-HYDROXYETHYL DISULFIDEA3G3X0.71
HED2-HYDROXYETHYL DISULFIDEA1CU20.71
HED2-HYDROXYETHYL DISULFIDEA1CX70.71
HED2-HYDROXYETHYL DISULFIDEA1PQO0.71
HED2-HYDROXYETHYL DISULFIDEX3DKE0.71
HED2-HYDROXYETHYL DISULFIDEA1CU60.71
HED2-HYDROXYETHYL DISULFIDEA238L0.71
HED2-HYDROXYETHYL DISULFIDEA2A4T0.71
HED2-HYDROXYETHYL DISULFIDEA1G060.71
HED2-HYDROXYETHYL DISULFIDEA211L0.71
HED2-HYDROXYETHYL DISULFIDEA1PQM0.71
HED2-HYDROXYETHYL DISULFIDEA1QT30.71
HED2-HYDROXYETHYL DISULFIDEA1ZWN0.71
HED2-HYDROXYETHYL DISULFIDEA1D3M0.71
HED2-HYDROXYETHYL DISULFIDEA1QT80.71
HED2-HYDROXYETHYL DISULFIDEA3DN30.71
HED2-HYDROXYETHYL DISULFIDEA1B6I0.71
HED2-HYDROXYETHYL DISULFIDEA1G0Q0.71
HED2-HYDROXYETHYL DISULFIDEA1G070.71
SGL1-HYDROXY-1-THIO-GLYCEROLA1QFM0.9
SGMMONOTHIOGLYCEROLA,B,C,D1OGU0.87
SGMMONOTHIOGLYCEROLA,B,C,D3DDQ0.87
SGMMONOTHIOGLYCEROLA,B,C,D3DOG0.87
SGMMONOTHIOGLYCEROLA1QFM0.87
SGMMONOTHIOGLYCEROLA,B,C,D1OIY0.87
SGMMONOTHIOGLYCEROLA,B,C,D3BHT0.87
SGMMONOTHIOGLYCEROLA,B,C,D1OIU0.87
SGMMONOTHIOGLYCEROLA,B,C,D2IW80.87
SGMMONOTHIOGLYCEROLA,B,C,D2IW60.87
SGMMONOTHIOGLYCEROLA,B,C,D3BHV0.87
SGMMONOTHIOGLYCEROLA,B,C,D1OI90.87
SGMMONOTHIOGLYCEROLA,B,C,D2IW90.87
DTO1-HYDROXYSULFANYL-4-MERCAPTO-BUTANE-
2,3-DIOL
A,B1QMH1
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
1HKX0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FX20.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2OLW0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1YRP0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H
2A270.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2V6V0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PX60.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N0H0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2BVJ0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1RAM0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N1C0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1W270.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2IYG0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2ZHG0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2E8E0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2I9F0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C2EAK0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1B2L0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1VD50.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMH0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3G360.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANED1V8Q0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2O300.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2V8V0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2G8X0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B3HP80.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BME0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H
1XXX0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D1DQ80.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1F0C0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1H0P0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1IAH0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2J980.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1EAC0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1X0J0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2HP00.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F3BBF0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1R430.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KV50.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMQ0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEB,C1X790.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1SV20.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2PNU0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2A2A0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1MW00.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FVG0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1ZLQ0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FA20.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D1O9J0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F2PAN0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2QSI0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2AMB0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA3GVT0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KZI0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1TIQ0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMO0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1YQD0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2AM90.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMF0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2CZD0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMD0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PLR0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA3FVE0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2ZHH0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMM0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PIJ0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1IA90.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F1F7T0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2IYI0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KAE0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N2F0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FW10.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1RE50.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2CKO0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1A780.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1DK80.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,D,E,F,G,
H,I
2BGC0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B5TIM0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C2VNF0.94
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1I3S0.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E1W190.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A1YVJ0.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D2RAM0.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A3F460.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D1NYT0.94
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3G360.94