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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01872036

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NLGN-ACETYL-L-GLUTAMATEA1OH90.72
NLGN-ACETYL-L-GLUTAMATEA1OHA0.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.72
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.72
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.72
NLGN-ACETYL-L-GLUTAMATEA3B8G0.72
NLGN-ACETYL-L-GLUTAMATEA1GS50.72
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.72
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.76
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.76
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.76
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.76
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.76
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.75
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.75
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.74
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.7
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.7
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.7
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.7
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
NSKN-SUCCINYL LYSINEA2P8B0.77
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.77
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.79
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
1GH00.79
MENN-METHYL ASPARAGINEA,B,C,D1XF60.79
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.79
MENN-METHYL ASPARAGINEA,B1I7Y0.79
MENN-METHYL ASPARAGINEA,B3BRP0.79
MENN-METHYL ASPARAGINEA,B1JBO0.79
MENN-METHYL ASPARAGINEA,B1ALL0.79
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.79
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
1HA70.79
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.79
MENN-METHYL ASPARAGINEA,B1KTP0.79
MENN-METHYL ASPARAGINEA,B1PHN0.79
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.79
MENN-METHYL ASPARAGINEA,B,C,D1XG00.79
MENN-METHYL ASPARAGINEA,B2VJT0.79
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.79
MENN-METHYL ASPARAGINEA,B2V8A0.79
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.79
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.8
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.8
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.8
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.8
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.8
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.8
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.7
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72