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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02879687

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5FP5,5,5-TRIFLUORO-3-HYDROXY-4-[2-
(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-
METHYL-2-[3-METHYL-2-(3-METHYL-
BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-
PENTANOYLAMINO)-PROPIONYLAMINO]-
PENTANOIC ACID
A,B1XE60.73
DTHD-THREONINEA1KRO0.71
DTHD-THREONINEA,B,C,D3BOG0.71
DTHD-THREONINEA,B173D0.71
DTHD-THREONINEA209D0.71
DTHD-THREONINEA316D0.71
DTHD-THREONINEA,B2Q330.71
DTHD-THREONINEA2JUE0.71
DTHD-THREONINEA2D550.71
PCV5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-
1-YL)-PENTANOIC ACID
A1DRT0.71
DSEN-METHYL-D-SERINEC1CWH0.73
5FE5,5,5-TRIFLUORO-3-HYDROXY-4-[2-
(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-
METHYL-2-[3-METHYL-2-(3-METHYL-
BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-
PENTANOYLAMINO)-PROPIONYLAMINO]-
PENTANOIC ACID METHYL ESTER
A,B1XE50.74
C6LN-hexanoyl-L-homoserineA3DHA0.7
C6LN-hexanoyl-L-homoserineA3DHB0.7
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.83
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.83
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.83
SACN-ACETYL-SERINEA1R4U0.83
SACN-ACETYL-SERINEA,B,C,D1WS30.83
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.83
SACN-ACETYL-SERINEA,B1EVU0.83
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.83
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.83
SACN-ACETYL-SERINEA1WRR0.83
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.83
SACN-ACETYL-SERINEA,B3CVQ0.83
SACN-ACETYL-SERINEA1B0B0.83
SACN-ACETYL-SERINEA1XT40.83
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.83
SACN-ACETYL-SERINEA2FXL0.83
SACN-ACETYL-SERINEA1R4S0.83
SACN-ACETYL-SERINEA,B,C,D1WS20.83
SACN-ACETYL-SERINEA,B,C,D2AUC0.83
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.83
SACN-ACETYL-SERINEA1R510.83
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.83
SACN-ACETYL-SERINEA,B,C,D1XXJ0.83
SACN-ACETYL-SERINET2QAC0.83
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.83
OLTO-METHYL-L-THREONINEA,B,C2AOC0.73
OLTO-METHYL-L-THREONINEA,B,C2AOD0.73
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.73
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
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.9
THCN-METHYLCARBONYLTHREONINEB2HR00.9
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.9
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.9
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.73
ALOALLO-THREONINEI,P1HDT0.71
ALOALLO-THREONINEA2JUU0.71
ALOALLO-THREONINEA2VMX0.71