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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483656

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NLGN-ACETYL-L-GLUTAMATEA1OH90.72
NLGN-ACETYL-L-GLUTAMATEA1OHA0.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.72
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.72
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.72
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.72
NLGN-ACETYL-L-GLUTAMATEA3B8G0.72
NLGN-ACETYL-L-GLUTAMATEA1GS50.72
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.72
BG1O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]-
L-serine
A2RG30.71
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B800.73
LNTN-[(2S)-2-amino-1,1-dihydroxy-4-
methylpentyl]-L-threonine
A,B,C3B7V0.73
NXAN-CARBOXYALANINEA2IUX0.72
NXAN-CARBOXYALANINEA1O8A0.72
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.97
THCN-METHYLCARBONYLTHREONINEB2HR00.97
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.97
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.97
59AN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCINE
A2DC80.71
DSEN-METHYL-D-SERINEC1CWH0.78
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.72
AMEN-ACETYLMETHIONINEA,B2J4Y0.72
DTHD-THREONINEA1KRO0.76
DTHD-THREONINEA,B,C,D3BOG0.76
DTHD-THREONINEA,B173D0.76
DTHD-THREONINEA209D0.76
DTHD-THREONINEA316D0.76
DTHD-THREONINEA,B2Q330.76
DTHD-THREONINEA2JUE0.76
DTHD-THREONINEA2D550.76
C99{(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]-
2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN-
1-YL}ACETIC ACID
A2HCG0.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.76
AN0N-ACETYL-L-NORVALINEA1ZQ80.76
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.7
PAUPANTOTHENOIC ACIDA,B2F9W0.71
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.71
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.71
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.71
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
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.72
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR90.71
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B,C,D,E,F1O7A0.71
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR80.71
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.77
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.71
OASO-ACETYLSERINEA,B,C,D,E,F,
G,H,I,J,K,L
2VAV0.72
OASO-ACETYLSERINEA2C580.72
OASO-ACETYLSERINEA1EBV0.72
OASO-ACETYLSERINEA,B,C,D,E,F,
G,H,I,J,K,L
2VAX0.72
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.78
N10O-[(HEXYLAMINO)CARBONYL]-L-SERINEA,B,C,D,E,F,
G,H
2Q0S0.74
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
HY33-HYDROXYPROLINEA,B,G2G660.73
PCV5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-
1-YL)-PENTANOIC ACID
A1DRT0.74
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.88
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.88
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.88
SACN-ACETYL-SERINEA1R4U0.88
SACN-ACETYL-SERINEA,B,C,D1WS30.88
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.88
SACN-ACETYL-SERINEA,B1EVU0.88
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.88
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.88
SACN-ACETYL-SERINEA1WRR0.88
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.88
SACN-ACETYL-SERINEA,B3CVQ0.88
SACN-ACETYL-SERINEA1B0B0.88
SACN-ACETYL-SERINEA1XT40.88
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.88
SACN-ACETYL-SERINEA2FXL0.88
SACN-ACETYL-SERINEA1R4S0.88
SACN-ACETYL-SERINEA,B,C,D1WS20.88
SACN-ACETYL-SERINEA,B,C,D2AUC0.88
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.88
SACN-ACETYL-SERINEA1R510.88
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.88
SACN-ACETYL-SERINEA,B,C,D1XXJ0.88
SACN-ACETYL-SERINET2QAC0.88
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.88
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.7
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.7
C6LN-hexanoyl-L-homoserineA3DHA0.74
C6LN-hexanoyl-L-homoserineA3DHB0.74
OLTO-METHYL-L-THREONINEA,B,C2AOC0.78
OLTO-METHYL-L-THREONINEA,B,C2AOD0.78
AYAN-ACETYLALANINEA1D0W0.76
AYAN-ACETYLALANINEA1AH40.76
AYAN-ACETYLALANINEA,B1VBP0.76
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.76
AYAN-ACETYLALANINEA,B,C,D1OUW0.76
AYAN-ACETYLALANINEA1AH30.76
AYAN-ACETYLALANINEA1EKO0.76
AYAN-ACETYLALANINEB,D,F,H2V4I0.76
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.76
AYAN-ACETYLALANINEA,B,C,D1J4U0.76
SUJ(2R,3R)-2-[(3S,6R)-3-AMINO-6-HYDROXY-
2-OXOPIPERIDINYL]-3-HYDROXYBUTANOIC ACID
C,D1OKX0.72
ALOALLO-THREONINEI,P1HDT0.76
ALOALLO-THREONINEA2JUU0.76
ALOALLO-THREONINEA2VMX0.76