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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02234165

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.74
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.72
RGS4N-MALONYL-CYSTEINYL-2,4-DIAMINOBUTYRATE DISULFIDEA4GR10.75
C6LN-hexanoyl-L-homoserineA3DHA0.76
C6LN-hexanoyl-L-homoserineA3DHB0.76
GSHGLUTATHIONEA,B,C,D,E,F1JLV0.71
GSHGLUTATHIONEA1EEM0.71
GSHGLUTATHIONEA,B1USB0.71
GSHGLUTATHIONEA3FZA0.71
GSHGLUTATHIONEA2IMF0.71
GSHGLUTATHIONEA,B1PX60.71
GSHGLUTATHIONEA,B1MD40.71
GSHGLUTATHIONEA2CZ20.71
GSHGLUTATHIONEA3FZ90.71
GSHGLUTATHIONEA,B,C,D1R4W0.71
GSHGLUTATHIONEA1ZHP0.71
GSHGLUTATHIONEA,B3E730.71
GSHGLUTATHIONEA1VF10.71
GSHGLUTATHIONEA3CRT0.71
GSHGLUTATHIONEA,B,C,D2VCX0.71
GSHGLUTATHIONEA,B,C,D1XW60.71
GSHGLUTATHIONEA3CRU0.71
GSHGLUTATHIONEA,B1B480.71
GSHGLUTATHIONEA2ZK20.71
GSHGLUTATHIONEA,B,C,D1IYH0.71
GSHGLUTATHIONEA,B,C,D1Q8M0.71
GSHGLUTATHIONEA,B,C,D2PBJ0.71
GSHGLUTATHIONEA,B,C,D2VCQ0.71
GSHGLUTATHIONEA1GRA0.71
GSHGLUTATHIONEA,B1QGJ0.71
GSHGLUTATHIONEA2HGS0.71
GSHGLUTATHIONEA,B,C,D2VD10.71
GSHGLUTATHIONEA1ZHM0.71
GSHGLUTATHIONEA,B,C,D2VCZ0.71
GSHGLUTATHIONEC1KCG0.71
GSHGLUTATHIONEA,B1MD30.71
GSHGLUTATHIONEA,B2IO90.71
GSHGLUTATHIONEA,B2JL40.71
GSHGLUTATHIONEA3DK80.71
GSHGLUTATHIONEA3DK40.71
GSHGLUTATHIONEA,B,D2VCW0.71
GSHGLUTATHIONEA,B1XW50.71
GSHGLUTATHIONEA,B3FHS0.71
GSHGLUTATHIONEA,B1Y1A0.71
GSHGLUTATHIONEA1GRE0.71
GSHGLUTATHIONEA,B2HT90.71
GSHGLUTATHIONEA,B1DUG0.71
GSHGLUTATHIONEA,B,C,D2VD00.71
GSHGLUTATHIONEA,B1TYP0.71
GSHGLUTATHIONEA2FLS0.71
GSHGLUTATHIONEA,B1OE80.71
GSHGLUTATHIONEA,B1PX70.71
GSHGLUTATHIONEA3C1S0.71
GSHGLUTATHIONEA,B1F3A0.71
GSHGLUTATHIONEA1FW10.71
GSHGLUTATHIONEA,B2IMI0.71
GSHGLUTATHIONEA,B1LBK0.71
GSHGLUTATHIONEA,B2HQM0.71
GSHGLUTATHIONEA,B1TDI0.71
GSHGLUTATHIONEA,B,C,D1V400.71
GSHGLUTATHIONEA,B,C,D1IYI0.71
GSHGLUTATHIONEA3D0Z0.71
GSHGLUTATHIONEA,B1ZGN0.71
GSHGLUTATHIONEA,B,C,D2CVD0.71
GSHGLUTATHIONEA,B3C8E0.71
GSHGLUTATHIONEA,B,C1YJ60.71
GSHGLUTATHIONEA2IMD0.71
GSHGLUTATHIONEA2IME0.71
GSHGLUTATHIONEA3BHJ0.71
GSHGLUTATHIONEA,B1OE70.71
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.84
AYAN-ACETYLALANINEA1D0W0.72
AYAN-ACETYLALANINEA1AH40.72
AYAN-ACETYLALANINEA,B1VBP0.72
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.72
AYAN-ACETYLALANINEA,B,C,D1OUW0.72
AYAN-ACETYLALANINEA1AH30.72
AYAN-ACETYLALANINEA1EKO0.72
AYAN-ACETYLALANINEB,D,F,H2V4I0.72
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.72
AYAN-ACETYLALANINEA,B,C,D1J4U0.72
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.82
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA,B,D,E,F3FDM0.7
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3HF00.7
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3C3H0.7
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.78
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.78
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.78
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.78
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.78
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.78
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.71
2Z9N-acetyl-L-alpha-aspartyl-L-alpha-
glutamyl-N-[(1R)-2-carboxy-1-formylethyl]-
L-valinamide
A,B3H1P0.7
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.83
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.83
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.83
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.83
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.76
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.81
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1GH00.81
MENN-METHYL ASPARAGINEA,B,C,D1XF60.81
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.81
MENN-METHYL ASPARAGINEA,B1I7Y0.81
MENN-METHYL ASPARAGINEA,B3BRP0.81
MENN-METHYL ASPARAGINEA,B1JBO0.81
MENN-METHYL ASPARAGINEA,B1ALL0.81
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.81
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1HA70.81
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.81
MENN-METHYL ASPARAGINEA,B1KTP0.81
MENN-METHYL ASPARAGINEA,B1PHN0.81
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.81
MENN-METHYL ASPARAGINEA,B,C,D1XG00.81
MENN-METHYL ASPARAGINEA,B2VJT0.81
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.81
MENN-METHYL ASPARAGINEA,B2V8A0.81
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.81
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.84
NLGN-ACETYL-L-GLUTAMATEA1OH90.76
NLGN-ACETYL-L-GLUTAMATEA1OHA0.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.76
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.76
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.76
NLGN-ACETYL-L-GLUTAMATEA3B8G0.76
NLGN-ACETYL-L-GLUTAMATEA1GS50.76
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.76
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.74
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.74
NSKN-SUCCINYL LYSINEA2P8B0.81
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA2F2K0.71
TGGGAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINEA,B2V6K0.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.72
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.72
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.72
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.81
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.73
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.73
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.82
GTTGLUTATHIONEA,B11GS0.71
GTTGLUTATHIONEA1GSN0.71
GTTGLUTATHIONEA,C1K0B0.71
GTTGLUTATHIONEA,B,C1K0D0.71
GTTGLUTATHIONEA,B6GSY0.71
GTTGLUTATHIONEA,B19GS0.71
GTTGLUTATHIONEA1FLJ0.71
GTTGLUTATHIONEA,B3DD30.71
GTTGLUTATHIONEA2PVQ0.71
GTTGLUTATHIONEA1DNC0.71
GTTGLUTATHIONEA,B,C,D,E,F,
G,H,I,J,K,L
2PNO0.71
GTTGLUTATHIONEA,B,C,D3CSI0.71
GTTGLUTATHIONEA,B6GSS0.71
GTTGLUTATHIONEA2R4V0.71
GTTGLUTATHIONEA,B,C,D3FZ50.71
GTTGLUTATHIONEA,B3GSS0.71
GTTGLUTATHIONEA,B2F8F0.71
GTTGLUTATHIONEA,B1GSY0.71
GTTGLUTATHIONEA1PMT0.71
GTTGLUTATHIONEA,B1GSE0.71
GTTGLUTATHIONEA,B,C,D1F2E0.71
GTTGLUTATHIONEA1UW30.71
GTTGLUTATHIONEA,B1SS40.71
GTTGLUTATHIONEA,B5GSS0.71
GTTGLUTATHIONEA1GRX0.71
GTTGLUTATHIONEA,B7GSS0.71
GTTGLUTATHIONEA1UA50.71
GTTGLUTATHIONEA,B,C8GSS0.71
GTTGLUTATHIONEA,B1LJR0.71
GTTGLUTATHIONEA,B,C,D1OYJ0.71
GTTGLUTATHIONEA,B,C,D2E7P0.71
GTTGLUTATHIONEA,B,C,D,E,F2GDR0.71
GTTGLUTATHIONEA,B,C,D2WEM0.71
GTTGLUTATHIONEA,B1K0A0.71
GTTGLUTATHIONEA,B3EE20.71
GTTGLUTATHIONEA3G5S0.71
GTTGLUTATHIONEA1HNL0.71
GTTGLUTATHIONEA,B,C,D1K0C0.71
GTTGLUTATHIONEA,B6GST0.71
GTTGLUTATHIONEA,B1TU70.71
GTTGLUTATHIONEA2H8A0.71
GTTGLUTATHIONEA,B,C,D2PMT0.71
GTTGLUTATHIONEA2UUH0.71
GTTGLUTATHIONEA,B1ZL90.71
GTTGLUTATHIONEA,B1QH50.71
GTTGLUTATHIONE1,21PD20.71
GTTGLUTATHIONEA,B3CSH0.71
GTTGLUTATHIONEA,C1JZR0.71
GTTGLUTATHIONEA2NTO0.71
GTTGLUTATHIONEA,B1KBN0.71
GTTGLUTATHIONEA3GRX0.71
GTTGLUTATHIONEA1B4Q0.71
GTTGLUTATHIONEA,B1PKW0.71
GTTGLUTATHIONEA1K0N0.71
GTTGLUTATHIONEA,B,C,D2DSA0.71
GTTGLUTATHIONEA,B2HNL0.71
GTTGLUTATHIONEA,B,C,D,E,F,
G,H
2ON50.71
GTTGLUTATHIONEA1GSA0.71
DSGD-ASPARAGINEA,B2Q330.74
DSGD-ASPARAGINEA2IH00.74
DSGD-ASPARAGINEA2JUE0.74
DSGD-ASPARAGINEA1A850.74
DSGD-ASPARAGINEA1T5N0.74
DSGD-ASPARAGINEA2IGZ0.74
DSGD-ASPARAGINEA,B,C,D3BOG0.74
DSGD-ASPARAGINEA1T5M0.74
DSGD-ASPARAGINEA,B1HXB0.74
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1FHE0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CA80.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1GNE0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B3D5J0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H
2VCR0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2WCI0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1OYJ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VCV0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U3I0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B,C,D1XA80.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B2BRQ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA2CAQ0.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA1U870.71
GSWD-GAMMA-GLUTAMYL-L-CYSTEINYLGLYCINEA,B1M0U0.71
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.79
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.79