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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01771948

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.7
AMEN-ACETYLMETHIONINEA,B2J4Y0.7
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.71
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.7
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.7
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.72
THCN-METHYLCARBONYLTHREONINEB2HR00.72
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.72
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.72
AYAN-ACETYLALANINEA1D0W0.75
AYAN-ACETYLALANINEA1AH40.75
AYAN-ACETYLALANINEA,B1VBP0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.75
AYAN-ACETYLALANINEA,B,C,D1OUW0.75
AYAN-ACETYLALANINEA1AH30.75
AYAN-ACETYLALANINEA1EKO0.75
AYAN-ACETYLALANINEB,D,F,H2V4I0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.75
AYAN-ACETYLALANINEA,B,C,D1J4U0.75
NXAN-CARBOXYALANINEA2IUX0.7
NXAN-CARBOXYALANINEA1O8A0.7
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.83
RGS4N-MALONYL-CYSTEINYL-2,4-DIAMINOBUTYRATE DISULFIDEA4GR10.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.84
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.84
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
DSGD-ASPARAGINEA,B2Q330.79
DSGD-ASPARAGINEA2IH00.79
DSGD-ASPARAGINEA2JUE0.79
DSGD-ASPARAGINEA1A850.79
DSGD-ASPARAGINEA1T5N0.79
DSGD-ASPARAGINEA2IGZ0.79
DSGD-ASPARAGINEA,B,C,D3BOG0.79
DSGD-ASPARAGINEA1T5M0.79
DSGD-ASPARAGINEA,B1HXB0.79
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.86
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
1GH00.86
MENN-METHYL ASPARAGINEA,B,C,D1XF60.86
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.86
MENN-METHYL ASPARAGINEA,B1I7Y0.86
MENN-METHYL ASPARAGINEA,B3BRP0.86
MENN-METHYL ASPARAGINEA,B1JBO0.86
MENN-METHYL ASPARAGINEA,B1ALL0.86
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.86
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
1HA70.86
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.86
MENN-METHYL ASPARAGINEA,B1KTP0.86
MENN-METHYL ASPARAGINEA,B1PHN0.86
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.86
MENN-METHYL ASPARAGINEA,B,C,D1XG00.86
MENN-METHYL ASPARAGINEA,B2VJT0.86
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.86
MENN-METHYL ASPARAGINEA,B2V8A0.86
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.86
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.73
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
NLGN-ACETYL-L-GLUTAMATEA1OH90.78
NLGN-ACETYL-L-GLUTAMATEA1OHA0.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.78
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.78
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.78
NLGN-ACETYL-L-GLUTAMATEA3B8G0.78
NLGN-ACETYL-L-GLUTAMATEA1GS50.78
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.78
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.76
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.76
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.86
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA,B,D,E,F3FDM0.72
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3HF00.72
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3C3H0.72
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.82
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.83
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.83
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.83
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.83
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.83
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.75
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.75
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.78
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.78
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.88
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.81
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.81
C6LN-hexanoyl-L-homoserineA3DHA0.7
C6LN-hexanoyl-L-homoserineA3DHB0.7
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.71
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.72
NSKN-SUCCINYL LYSINEA2P8B0.81
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
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.79
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.79
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.79
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.79
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.79
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77
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
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.71
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.71
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.71
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.71
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.71
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.71
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.71
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.71
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
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75