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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02337000

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.75
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.79
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
NSKN-SUCCINYL LYSINEA2P8B0.78
NSNN~2~-(2-AMINO-1-METHYL-2-OXOETHYLIDENE)ASPARAGINATEA1UHE0.71
NLGN-ACETYL-L-GLUTAMATEA1OH90.73
NLGN-ACETYL-L-GLUTAMATEA1OHA0.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.73
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.73
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.73
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.73
NLGN-ACETYL-L-GLUTAMATEA3B8G0.73
NLGN-ACETYL-L-GLUTAMATEA1GS50.73
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.73
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.75
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
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.75
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.81
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.8
C6LN-hexanoyl-L-homoserineA3DHA0.72
C6LN-hexanoyl-L-homoserineA3DHB0.72
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.77
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.77
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.77
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.77
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.77
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.81
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.81
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.81
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.81
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.81
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.81
DSGD-ASPARAGINEA,B2Q330.73
DSGD-ASPARAGINEA2IH00.73
DSGD-ASPARAGINEA2JUE0.73
DSGD-ASPARAGINEA1A850.73
DSGD-ASPARAGINEA1T5N0.73
DSGD-ASPARAGINEA2IGZ0.73
DSGD-ASPARAGINEA,B,C,D3BOG0.73
DSGD-ASPARAGINEA1T5M0.73
DSGD-ASPARAGINEA,B1HXB0.73
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
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.8
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
1GH00.8
MENN-METHYL ASPARAGINEA,B,C,D1XF60.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.8
MENN-METHYL ASPARAGINEA,B1I7Y0.8
MENN-METHYL ASPARAGINEA,B3BRP0.8
MENN-METHYL ASPARAGINEA,B1JBO0.8
MENN-METHYL ASPARAGINEA,B1ALL0.8
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.8
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
1HA70.8
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.8
MENN-METHYL ASPARAGINEA,B1KTP0.8
MENN-METHYL ASPARAGINEA,B1PHN0.8
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.8
MENN-METHYL ASPARAGINEA,B,C,D1XG00.8
MENN-METHYL ASPARAGINEA,B2VJT0.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.8
MENN-METHYL ASPARAGINEA,B2V8A0.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.8