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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00484107

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.72
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.72
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.72
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.8
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.78
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.77
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
1GH00.77
MENN-METHYL ASPARAGINEA,B,C,D1XF60.77
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.77
MENN-METHYL ASPARAGINEA,B1I7Y0.77
MENN-METHYL ASPARAGINEA,B3BRP0.77
MENN-METHYL ASPARAGINEA,B1JBO0.77
MENN-METHYL ASPARAGINEA,B1ALL0.77
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.77
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
1HA70.77
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.77
MENN-METHYL ASPARAGINEA,B1KTP0.77
MENN-METHYL ASPARAGINEA,B1PHN0.77
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.77
MENN-METHYL ASPARAGINEA,B,C,D1XG00.77
MENN-METHYL ASPARAGINEA,B2VJT0.77
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.77
MENN-METHYL ASPARAGINEA,B2V8A0.77
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.77
BUJ(3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoateA,B2RCU0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.78
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
RGS4N-MALONYL-CYSTEINYL-2,4-DIAMINOBUTYRATE DISULFIDEA4GR10.72
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
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.7
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.7
DSGD-ASPARAGINEA,B2Q330.7
DSGD-ASPARAGINEA2IH00.7
DSGD-ASPARAGINEA2JUE0.7
DSGD-ASPARAGINEA1A850.7
DSGD-ASPARAGINEA1T5N0.7
DSGD-ASPARAGINEA2IGZ0.7
DSGD-ASPARAGINEA,B,C,D3BOG0.7
DSGD-ASPARAGINEA1T5M0.7
DSGD-ASPARAGINEA,B1HXB0.7
NSNN~2~-(2-AMINO-1-METHYL-2-OXOETHYLIDENE)ASPARAGINATEA1UHE0.74
C6LN-hexanoyl-L-homoserineA3DHA0.7
C6LN-hexanoyl-L-homoserineA3DHB0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.76
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.76
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.76
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.76
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.74
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.74
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.74
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.74
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.74