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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03091728

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.73
TH5O-acetyl-L-threonineA,D,E,F,G,H2VZK0.71
H5MTRANS-3-HYDROXY-5-METHYLPROLINEA,B1A7Z0.71
074[PROPYLAMINO-3-HYDROXY-BUTAN-1,4-
DIONYL]-ISOLEUCYL-PROLINE
A1QDQ0.7
042N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-THREONYL-L-ISOLEUCINE
A2DC70.71
75VN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCYL-L-ALANINE
A2DCA0.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.77
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.77
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.77
SACN-ACETYL-SERINEA1R4U0.77
SACN-ACETYL-SERINEA,B,C,D1WS30.77
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.77
SACN-ACETYL-SERINEA,B1EVU0.77
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.77
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.77
SACN-ACETYL-SERINEA1WRR0.77
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.77
SACN-ACETYL-SERINEA,B3CVQ0.77
SACN-ACETYL-SERINEA1B0B0.77
SACN-ACETYL-SERINEA1XT40.77
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.77
SACN-ACETYL-SERINEA2FXL0.77
SACN-ACETYL-SERINEA1R4S0.77
SACN-ACETYL-SERINEA,B,C,D1WS20.77
SACN-ACETYL-SERINEA,B,C,D2AUC0.77
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.77
SACN-ACETYL-SERINEA1R510.77
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.77
SACN-ACETYL-SERINEA,B,C,D1XXJ0.77
SACN-ACETYL-SERINET2QAC0.77
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.77
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR90.74
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B,C,D,E,F1O7A0.74
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR80.74
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.85
THCN-METHYLCARBONYLTHREONINEB2HR00.85
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.85
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.85
BG1O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]-
L-serine
A2RG30.7
HY33-HYDROXYPROLINEA,B,G2G660.74
PCV5-AMINO-3-HYDROXY-2-(2-OXO-AZETIDIN-
1-YL)-PENTANOIC ACID
A1DRT0.73
OPIPANTOTHENYL-AMINOETHANOL-11-PIVALIC ACIDA,B,C,D2VU10.71
C6LN-hexanoyl-L-homoserineA3DHA0.78
C6LN-hexanoyl-L-homoserineA3DHB0.78
C99{(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]-
2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN-
1-YL}ACETIC ACID
A2HCG0.74
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.72
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.72
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.72
PAUPANTOTHENOIC ACIDA,B2F9W0.72
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.72
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.72
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.72
HTFN-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDEA2AVX0.76
168PANTOTHENYL-AMINOETHANOL-ACETATE PIVALIC ACIDA,B,C,D1OU60.71
59AN-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN-
2-YL]CARBONYL}-L-ISOLEUCINE
A2DC80.74
HYP4-HYDROXYPROLINEA1OB40.73
HYP4-HYDROXYPROLINEA,B,C1QSU0.73
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.73
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.73
HYP4-HYDROXYPROLINEA1TCH0.73
HYP4-HYDROXYPROLINEA1KCP0.73
HYP4-HYDROXYPROLINEA2JTU0.73
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.73
HYP4-HYDROXYPROLINEA3E2Q0.73
HYP4-HYDROXYPROLINEA1TR60.73
HYP4-HYDROXYPROLINEA1P1P0.73
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.73
HYP4-HYDROXYPROLINEA,B,C,D2V530.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.73
HYP4-HYDROXYPROLINEA2VUV0.73
HYP4-HYDROXYPROLINEA1EYO0.73
HYP4-HYDROXYPROLINED,H2FES0.73
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.73
HYP4-HYDROXYPROLINEA2JQB0.73
HYP4-HYDROXYPROLINEA2P4L0.73
HYP4-HYDROXYPROLINEA2H9X0.73
HYP4-HYDROXYPROLINEA1AV30.73
HYP4-HYDROXYPROLINEA1TCJ0.73
HYP4-HYDROXYPROLINEA2IHA0.73
HYP4-HYDROXYPROLINEA,B,C1BKV0.73
HYP4-HYDROXYPROLINEA1R9U0.73
HYP4-HYDROXYPROLINEA1AG70.73
HYP4-HYDROXYPROLINEA1GQ00.73
HYP4-HYDROXYPROLINEA1R9I0.73
HYP4-HYDROXYPROLINEH1LM80.73
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.73
HYP4-HYDROXYPROLINEA,B,C1Q7D0.73
HYP4-HYDROXYPROLINEA1VIB0.73
HYP4-HYDROXYPROLINED,H2FEQ0.73
HYP4-HYDROXYPROLINEA1DG00.73
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.73
HYP4-HYDROXYPROLINEA1GIB0.73
HYP4-HYDROXYPROLINEA,D1LQB0.73
HYP4-HYDROXYPROLINEA,B,C3DMW0.73
HYP4-HYDROXYPROLINEA2JQC0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.73
HYP4-HYDROXYPROLINEA1IEO0.73
HYP4-HYDROXYPROLINED,H1NZQ0.73
HYP4-HYDROXYPROLINEA2JRY0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.73
HYP4-HYDROXYPROLINEA,B1JOH0.73
HYP4-HYDROXYPROLINEA1PQR0.73
HYP4-HYDROXYPROLINEA1TTL0.73
HYP4-HYDROXYPROLINEA2B5Q0.73
HYP4-HYDROXYPROLINEA,B,C1CAG0.73
HYP4-HYDROXYPROLINEA2EW40.73
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.73
HYP4-HYDROXYPROLINEA2YYF0.73
HYP4-HYDROXYPROLINEA1G1P0.73
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.73
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.73
HYP4-HYDROXYPROLINEA2VUZ0.73
HYP4-HYDROXYPROLINEA1QFB0.73
HYP4-HYDROXYPROLINED,H1O0D0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.73
HYP4-HYDROXYPROLINEA2J150.73
HYP4-HYDROXYPROLINEA1DFZ0.73
HYP4-HYDROXYPROLINEA,B1OB60.73
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.73
HYP4-HYDROXYPROLINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.73
HYP4-HYDROXYPROLINEA1TCK0.73
HYP4-HYDROXYPROLINEA1G1Z0.73
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.73
HYP4-HYDROXYPROLINEA1MTQ0.73
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.73
HYP4-HYDROXYPROLINEA,B,C1V7H0.73
HYP4-HYDROXYPROLINEA,B,G2G660.73
HYP4-HYDROXYPROLINEA1OB70.73
HYP4-HYDROXYPROLINEA1OMC0.73
HYP4-HYDROXYPROLINEX2HCZ0.73
HYP4-HYDROXYPROLINEA1DFY0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.73
HYP4-HYDROXYPROLINEA1IH90.73
HYP4-HYDROXYPROLINEA2IH60.73
HYP4-HYDROXYPROLINEA2IH70.73
HYP4-HYDROXYPROLINEA1JLP0.73
HYP4-HYDROXYPROLINEA,C,E,F2W650.73
HYP4-HYDROXYPROLINEA1AS50.73
HYP4-HYDROXYPROLINEA,B,C1V6Q0.73
HYP4-HYDROXYPROLINEA,B,C1V4F0.73
HYP4-HYDROXYPROLINEA,B,C1Y0F0.73
HYP4-HYDROXYPROLINEA,B,C2DRX0.73
HYP4-HYDROXYPROLINEA1K640.73
HYP4-HYDROXYPROLINEA,B,C1YGV0.73
HYP4-HYDROXYPROLINEA2B5P0.73
HYP4-HYDROXYPROLINEA,B,C2DRT0.73
HYP4-HYDROXYPROLINEA2CCO0.73
HYP4-HYDROXYPROLINEA1WCT0.73
HYP4-HYDROXYPROLINEA1D7T0.73
HYP4-HYDROXYPROLINEA1JLO0.73
HYP4-HYDROXYPROLINEA,B,C1CGD0.73
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.73
HYP4-HYDROXYPROLINEH,P2A2X0.73
HYP4-HYDROXYPROLINEA1DLZ0.73
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.73
HYP4-HYDROXYPROLINEA1TCG0.73
HYP4-HYDROXYPROLINEH,P2ANK0.73
HYP4-HYDROXYPROLINEA,B,C1WZB0.73
HYP4-HYDROXYPROLINEA1BDK0.73
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.75
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72
OHNN-3-OXO-DODECANOYL-L-HOMOSERINE LACTONEE,F,G,H2UV00.74
LAE3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO-
FURAN-3-YL)-AMIDE
A,B,C,D1L3L0.75
LAE3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO-
FURAN-3-YL)-AMIDE
A,B2Q0O0.75