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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03505236

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,B2E680.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.77
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
AYAN-ACETYLALANINEA1D0W0.74
AYAN-ACETYLALANINEA1AH40.74
AYAN-ACETYLALANINEA,B1VBP0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.74
AYAN-ACETYLALANINEA,B,C,D1OUW0.74
AYAN-ACETYLALANINEA1AH30.74
AYAN-ACETYLALANINEA1EKO0.74
AYAN-ACETYLALANINEB,D,F,H2V4I0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.74
AYAN-ACETYLALANINEA,B,C,D1J4U0.74
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
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
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
NSKN-SUCCINYL LYSINEA2P8B0.77
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.7
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.84
SIC(2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin-
1-yl]-3-sulfanylpropanoic acid
A,B3DIP0.7
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.75
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.75
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.75
NSNN~2~-(2-AMINO-1-METHYL-2-OXOETHYLIDENE)ASPARAGINATEA1UHE0.74
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.83
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.71
DSGD-ASPARAGINEA,B2Q330.75
DSGD-ASPARAGINEA2IH00.75
DSGD-ASPARAGINEA2JUE0.75
DSGD-ASPARAGINEA1A850.75
DSGD-ASPARAGINEA1T5N0.75
DSGD-ASPARAGINEA2IGZ0.75
DSGD-ASPARAGINEA,B,C,D3BOG0.75
DSGD-ASPARAGINEA1T5M0.75
DSGD-ASPARAGINEA,B1HXB0.75
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
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75