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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483381

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.71
ATIN-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACIDA1Y0Y0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.77
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.77
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.71
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.72
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.72
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.72
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.75
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.72
C6LN-hexanoyl-L-homoserineA3DHA0.77
C6LN-hexanoyl-L-homoserineA3DHB0.77
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.71
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
1GH00.71
MENN-METHYL ASPARAGINEA,B,C,D1XF60.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.71
MENN-METHYL ASPARAGINEA,B1I7Y0.71
MENN-METHYL ASPARAGINEA,B3BRP0.71
MENN-METHYL ASPARAGINEA,B1JBO0.71
MENN-METHYL ASPARAGINEA,B1ALL0.71
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.71
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
1HA70.71
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.71
MENN-METHYL ASPARAGINEA,B1KTP0.71
MENN-METHYL ASPARAGINEA,B1PHN0.71
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.71
MENN-METHYL ASPARAGINEA,B,C,D1XG00.71
MENN-METHYL ASPARAGINEA,B2VJT0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.71
MENN-METHYL ASPARAGINEA,B2V8A0.71
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.71
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.73
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.73
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.73
LAA(3R)-3-hydroxy-L-alpha-asparagineA1CCF0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.81
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.81
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.81
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.81
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.81
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.71
AYAN-ACETYLALANINEA1D0W0.71
AYAN-ACETYLALANINEA1AH40.71
AYAN-ACETYLALANINEA,B1VBP0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.71
AYAN-ACETYLALANINEA,B,C,D1OUW0.71
AYAN-ACETYLALANINEA1AH30.71
AYAN-ACETYLALANINEA1EKO0.71
AYAN-ACETYLALANINEB,D,F,H2V4I0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.71
AYAN-ACETYLALANINEA,B,C,D1J4U0.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.79
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.79
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.79
SACN-ACETYL-SERINEA1R4U0.79
SACN-ACETYL-SERINEA,B,C,D1WS30.79
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.79
SACN-ACETYL-SERINEA,B1EVU0.79
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.79
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.79
SACN-ACETYL-SERINEA1WRR0.79
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.79
SACN-ACETYL-SERINEA,B3CVQ0.79
SACN-ACETYL-SERINEA1B0B0.79
SACN-ACETYL-SERINEA1XT40.79
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.79
SACN-ACETYL-SERINEA2FXL0.79
SACN-ACETYL-SERINEA1R4S0.79
SACN-ACETYL-SERINEA,B,C,D1WS20.79
SACN-ACETYL-SERINEA,B,C,D2AUC0.79
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.79
SACN-ACETYL-SERINEA1R510.79
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.79
SACN-ACETYL-SERINEA,B,C,D1XXJ0.79
SACN-ACETYL-SERINET2QAC0.79
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.79
PCV5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-
1-YL)-PENTANOIC ACID
A1DRT0.72