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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02336614

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SSO1,4-DIDEOXY-1,4-[[2S,3S)-2,4-DIHYDROXY-
3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]-
D-ARABINITOL INNER SALT
A1TQS0.86
ASU4'-THIO-2'4'-DIDEOXYRIBOFURANOSE-
5'-PHOSPHATE
A,B1EMJ0.74
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N
1HKX0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FX20.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2OLW0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1YRP0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H
2A270.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2V6V0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PX60.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N0H0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2BVJ0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1RAM0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N1C0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1W270.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2IYG0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2ZHG0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2E8E0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2I9F0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C2EAK0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1B2L0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1VD50.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMH0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3G360.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANED1V8Q0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2O300.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2V8V0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2G8X0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B3HP80.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BME0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F,
G,H
1XXX0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D1DQ80.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1F0C0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1H0P0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1IAH0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2J980.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1EAC0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1X0J0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2HP00.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F3BBF0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1R430.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KV50.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMQ0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEB,C1X790.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1SV20.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2PNU0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D2A2A0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1MW00.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FVG0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1ZLQ0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FA20.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D1O9J0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F2PAN0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2QSI0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2AMB0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA3GVT0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KZI0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1TIQ0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMO0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1YQD0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2AM90.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMF0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2CZD0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMD0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PLR0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA3FVE0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA2ZHH0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D3BMM0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2PIJ0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1IA90.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C,D,E,F1F7T0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2IYI0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1KAE0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1N2F0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1FW10.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1RE50.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B2CKO0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B1A780.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA1DK80.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,D,E,F,G,
H,I
2BGC0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B5TIM0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C2VNF0.7
DTT2,3-DIHYDROXY-1,4-DITHIOBUTANEA,B,C1I3S0.7
NK2(1R,6S,7R,8S)-1-THIONIABICYCLO[4.3.0]NONAN-
7,8-DIOL
A2OW70.73
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E1W190.7
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A1YVJ0.7
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D2RAM0.7
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A3F460.7
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D1NYT0.7
DTV(2S,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3G360.7
NK1(1R,5S,6S,7R,8S)-1-THIONIABICYCLO[4.3.0]NONAN-
5,7,8-TRIOL
A2OW60.74
GLT5-DEOXY-5-THIO-ALPHA-D-GLUCOSEA,B1XLI0.74
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B2IYG0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D1O9J0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A3H9M0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3G360.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B1KZI0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A1YWM0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B1TV80.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E,F,
G,H
1W4R0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E2C920.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B2IYI0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D3C610.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C,D,E1W190.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A2VK30.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C2VNF0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,D,E,F,G,
H,I
2BGC0.7
DTU(2R,3S)-1,4-DIMERCAPTOBUTANE-2,3-
DIOL
A,B,C2H000.7
SR15-S-METHYL-5-THIO-ALPHA-D-RIBOFURANOSEA,B2PUN0.72
SR15-S-METHYL-5-THIO-ALPHA-D-RIBOFURANOSEA,B1Z5N0.72
SR15-S-METHYL-5-THIO-ALPHA-D-RIBOFURANOSEA,B2PYW0.72
SSD1,4-DIDEOXY-1,4-[[2R,3R)-2,4-DIHYDROXY-
3-(SULFOXY)BUTYL]EPISULFONIUMYLIDENE]-
D-ARABINITOL INNER SALT
A1TQT0.86