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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03854219

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ALYN(6)-ACETYLLYSINEA,B2B4D0.71
ALYN(6)-ACETYLLYSINEA,B2OD90.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.71
ALYN(6)-ACETYLLYSINEA,B2B5G0.71
ALYN(6)-ACETYLLYSINEA2GIV0.71
ALYN(6)-ACETYLLYSINEB2RNY0.71
ALYN(6)-ACETYLLYSINEA1JSP0.71
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.71
ALYN(6)-ACETYLLYSINEA,D3D4B0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.71
ALYN(6)-ACETYLLYSINEA,B2R0Y0.71
ALYN(6)-ACETYLLYSINEA3CZ70.71
ALYN(6)-ACETYLLYSINEA1JM40.71
ALYN(6)-ACETYLLYSINEA,B2H4H0.71
ALYN(6)-ACETYLLYSINEA,B2J6V0.71
ALYN(6)-ACETYLLYSINEA,B2R100.71
ALYN(6)-ACETYLLYSINEA,B1YC50.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.71
ALYN(6)-ACETYLLYSINEA,B2H2G0.71
ALYN(6)-ACETYLLYSINEA,D2H4F0.71
ALYN(6)-ACETYLLYSINEA2OU20.71
ALYN(6)-ACETYLLYSINEA,B1S5P0.71
ALYN(6)-ACETYLLYSINEB2RNW0.71
ALYN(6)-ACETYLLYSINEA3D350.71
ALYN(6)-ACETYLLYSINEA,B2OD20.71
ALYN(6)-ACETYLLYSINEA2ZFN0.71
ALYN(6)-ACETYLLYSINEC,D2C1J0.71
ALYN(6)-ACETYLLYSINEA,B2QQG0.71
ALYN(6)-ACETYLLYSINEB2RNX0.71
ALYN(6)-ACETYLLYSINEA,B1MA30.71
ALYN(6)-ACETYLLYSINEA,B2H2H0.71
ALYN(6)-ACETYLLYSINEA2I2Z0.71
ALYN(6)-ACETYLLYSINEA,B2OD70.71
ALYN(6)-ACETYLLYSINEP1E6I0.71
ALYN(6)-ACETYLLYSINEA,B1SZC0.71
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.71
ALYN(6)-ACETYLLYSINEA,B2H2D0.71
ALYN(6)-ACETYLLYSINEA,B1Q1A0.71
ALYN(6)-ACETYLLYSINEA,B1SZD0.71
ALYN(6)-ACETYLLYSINEQ,R2E3K0.71
ALYN(6)-ACETYLLYSINEA2OZU0.71
ALYN(6)-ACETYLLYSINEA,B2QQF0.71
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.71
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.71
GTXS-HEXYLGLUTATHIONEA,B1AGS0.71
GTXS-HEXYLGLUTATHIONEA,B1PN90.71
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.71
GTXS-HEXYLGLUTATHIONEA,B2IMK0.71
GTXS-HEXYLGLUTATHIONEA,B4GSS0.71
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.71
GTXS-HEXYLGLUTATHIONEA,B2GLR0.71
GTXS-HEXYLGLUTATHIONEA,B2OA70.71
GTXS-HEXYLGLUTATHIONEA,C2AAW0.71
GTXS-HEXYLGLUTATHIONEA,B1VF20.71
GTXS-HEXYLGLUTATHIONEA1M9A0.71
GTXS-HEXYLGLUTATHIONEA,B17GS0.71
GTXS-HEXYLGLUTATHIONEA,B1K0A0.71
GTXS-HEXYLGLUTATHIONEA,B2R3X0.71
GTXS-HEXYLGLUTATHIONEA,B1GSU0.71
GTXS-HEXYLGLUTATHIONEA,B2C800.71
GTXS-HEXYLGLUTATHIONEA,B2R6K0.71
GTXS-HEXYLGLUTATHIONEA,B1PGT0.71
GTXS-HEXYLGLUTATHIONEA,B2J9H0.71
GTXS-HEXYLGLUTATHIONEA,B1K3L0.71
GTXS-HEXYLGLUTATHIONEA,B1GNW0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.71
GTXS-HEXYLGLUTATHIONEA,B1YDK0.71
GTXS-HEXYLGLUTATHIONEA,B9GSS0.71
DI63-[(4S)-2,5-DIOXOIMIDAZOLIDIN-4-
YL]PROPANOIC ACID
A2Q090.78
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.73
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.73
NC44-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACIDA1ZD30.74
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.78
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.73
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CAY0.73
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CBA0.73
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.73
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.73
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.72
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.72
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.7
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.7
GTTGLUTATHIONEA,B11GS0.72
GTTGLUTATHIONEA1GSN0.72
GTTGLUTATHIONEA,C1K0B0.72
GTTGLUTATHIONEA,B,C1K0D0.72
GTTGLUTATHIONEA,B6GSY0.72
GTTGLUTATHIONEA,B19GS0.72
GTTGLUTATHIONEA1FLJ0.72
GTTGLUTATHIONEA,B3DD30.72
GTTGLUTATHIONEA2PVQ0.72
GTTGLUTATHIONEA1DNC0.72
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.72
GTTGLUTATHIONEA,B,C,D3CSI0.72
GTTGLUTATHIONEA,B6GSS0.72
GTTGLUTATHIONEA2R4V0.72
GTTGLUTATHIONEA,B,C,D3FZ50.72
GTTGLUTATHIONEA,B3GSS0.72
GTTGLUTATHIONEA,B2F8F0.72
GTTGLUTATHIONEA,B1GSY0.72
GTTGLUTATHIONEA1PMT0.72
GTTGLUTATHIONEA,B1GSE0.72
GTTGLUTATHIONEA,B,C,D1F2E0.72
GTTGLUTATHIONEA1UW30.72
GTTGLUTATHIONEA,B1SS40.72
GTTGLUTATHIONEA,B5GSS0.72
GTTGLUTATHIONEA1GRX0.72
GTTGLUTATHIONEA,B7GSS0.72
GTTGLUTATHIONEA1UA50.72
GTTGLUTATHIONEA,B,C8GSS0.72
GTTGLUTATHIONEA,B1LJR0.72
GTTGLUTATHIONEA,B,C,D1OYJ0.72
GTTGLUTATHIONEA,B,C,D2E7P0.72
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.72
GTTGLUTATHIONEA,B,C,D2WEM0.72
GTTGLUTATHIONEA,B1K0A0.72
GTTGLUTATHIONEA,B3EE20.72
GTTGLUTATHIONEA3G5S0.72
GTTGLUTATHIONEA1HNL0.72
GTTGLUTATHIONEA,B,C,D1K0C0.72
GTTGLUTATHIONEA,B6GST0.72
GTTGLUTATHIONEA,B1TU70.72
GTTGLUTATHIONEA2H8A0.72
GTTGLUTATHIONEA,B,C,D2PMT0.72
GTTGLUTATHIONEA2UUH0.72
GTTGLUTATHIONEA,B1ZL90.72
GTTGLUTATHIONEA,B1QH50.72
GTTGLUTATHIONE1,21PD20.72
GTTGLUTATHIONEA,B3CSH0.72
GTTGLUTATHIONEA,C1JZR0.72
GTTGLUTATHIONEA2NTO0.72
GTTGLUTATHIONEA,B1KBN0.72
GTTGLUTATHIONEA3GRX0.72
GTTGLUTATHIONEA1B4Q0.72
GTTGLUTATHIONEA,B1PKW0.72
GTTGLUTATHIONEA1K0N0.72
GTTGLUTATHIONEA,B,C,D2DSA0.72
GTTGLUTATHIONEA,B2HNL0.72
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.72
GTTGLUTATHIONEA1GSA0.72
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
NSKN-SUCCINYL LYSINEA2P8B0.7
CIRCITRULLINEA,B,C,D1J210.75
CIRCITRULLINEB1KOD0.75
CIRCITRULLINEA,B,C3B3I0.75
CIRCITRULLINEC3DTX0.75
CIRCITRULLINEA2C6Z0.75
CIRCITRULLINEA,C,E,F2W650.75
CIRCITRULLINEA,B2JAI0.75
CIRCITRULLINEP3FT20.75
CIRCITRULLINEA,B,C,D1J1Z0.75
CIRCITRULLINEA,B1LXY0.75
CIRCITRULLINEF,H1OL10.75
CIRCITRULLINEA1KP30.75
CIRCITRULLINEA2NZ20.75
CIRCITRULLINEA1H700.75
CIRCITRULLINEA1K970.75
CIRCITRULLINEC3B6S0.75
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.72
TS5GLUTATHIONYLSPERMIDINEA1I5G0.72
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA1GVG0.71
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA,B1MC10.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.75
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.75
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.72
GSHGLUTATHIONEA1EEM0.72
GSHGLUTATHIONEA,B1USB0.72
GSHGLUTATHIONEA3FZA0.72
GSHGLUTATHIONEA2IMF0.72
GSHGLUTATHIONEA,B1PX60.72
GSHGLUTATHIONEA,B1MD40.72
GSHGLUTATHIONEA2CZ20.72
GSHGLUTATHIONEA3FZ90.72
GSHGLUTATHIONEA,B,C,D1R4W0.72
GSHGLUTATHIONEA1ZHP0.72
GSHGLUTATHIONEA,B3E730.72
GSHGLUTATHIONEA1VF10.72
GSHGLUTATHIONEA3CRT0.72
GSHGLUTATHIONEA,B,C,D2VCX0.72
GSHGLUTATHIONEA,B,C,D1XW60.72
GSHGLUTATHIONEA3CRU0.72
GSHGLUTATHIONEA,B1B480.72
GSHGLUTATHIONEA2ZK20.72
GSHGLUTATHIONEA,B,C,D1IYH0.72
GSHGLUTATHIONEA,B,C,D1Q8M0.72
GSHGLUTATHIONEA,B,C,D2PBJ0.72
GSHGLUTATHIONEA,B,C,D2VCQ0.72
GSHGLUTATHIONEA1GRA0.72
GSHGLUTATHIONEA,B1QGJ0.72
GSHGLUTATHIONEA2HGS0.72
GSHGLUTATHIONEA,B,C,D2VD10.72
GSHGLUTATHIONEA1ZHM0.72
GSHGLUTATHIONEA,B,C,D2VCZ0.72
GSHGLUTATHIONEC1KCG0.72
GSHGLUTATHIONEA,B1MD30.72
GSHGLUTATHIONEA,B2IO90.72
GSHGLUTATHIONEA,B2JL40.72
GSHGLUTATHIONEA3DK80.72
GSHGLUTATHIONEA3DK40.72
GSHGLUTATHIONEA,B,D2VCW0.72
GSHGLUTATHIONEA,B1XW50.72
GSHGLUTATHIONEA,B3FHS0.72
GSHGLUTATHIONEA,B1Y1A0.72
GSHGLUTATHIONEA1GRE0.72
GSHGLUTATHIONEA,B2HT90.72
GSHGLUTATHIONEA,B1DUG0.72
GSHGLUTATHIONEA,B,C,D2VD00.72
GSHGLUTATHIONEA,B1TYP0.72
GSHGLUTATHIONEA2FLS0.72
GSHGLUTATHIONEA,B1OE80.72
GSHGLUTATHIONEA,B1PX70.72
GSHGLUTATHIONEA3C1S0.72
GSHGLUTATHIONEA,B1F3A0.72
GSHGLUTATHIONEA1FW10.72
GSHGLUTATHIONEA,B2IMI0.72
GSHGLUTATHIONEA,B1LBK0.72
GSHGLUTATHIONEA,B2HQM0.72
GSHGLUTATHIONEA,B1TDI0.72
GSHGLUTATHIONEA,B,C,D1V400.72
GSHGLUTATHIONEA,B,C,D1IYI0.72
GSHGLUTATHIONEA3D0Z0.72
GSHGLUTATHIONEA,B1ZGN0.72
GSHGLUTATHIONEA,B,C,D2CVD0.72
GSHGLUTATHIONEA,B3C8E0.72
GSHGLUTATHIONEA,B,C1YJ60.72
GSHGLUTATHIONEA2IMD0.72
GSHGLUTATHIONEA2IME0.72
GSHGLUTATHIONEA3BHJ0.72
GSHGLUTATHIONEA,B1OE70.72
NC77-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEPTANOIC ACIDA1ZD50.72
TS22-AMINO-4-[4-(4-AMINO-4-CARBOXY-
BUTYRYLAMINO)-5,8,19,22-TETRAOXO-
1,2-DITHIA-6,9,13,18,21-PENTAAZA-
CYCLOTETRACOS-23-YLCARBAMOYL]-BUTYRIC ACID
A3GRT0.7
GDSOXIDIZED GLUTATHIONE DISULFIDEA,B1YKC0.71
GDSOXIDIZED GLUTATHIONE DISULFIDEA2GRT0.71
GDSOXIDIZED GLUTATHIONE DISULFIDEA3GX00.71
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F,
G,H,I,J
2DB41
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS1
GLHN-5-CYCLOHEXYL-N-5-[(CYCLOHEXYLAMINO)CARBONYL]GLUTAMINEA,B,C,D,E,F1E791
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.73
MEQN5-METHYLGLUTAMINEA,B1NV80.74
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.7
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.7
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.7
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.7
NC66-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEXANOIC ACIDA1ZD40.75