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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00484015

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.76
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
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.75
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.75
MAAN-METHYLALANINEA,B1A7Z0.74
MAAN-METHYLALANINEA,B2VSL0.74
MAAN-METHYLALANINEC1CWI0.74
MAAN-METHYLALANINEC,F,G,H3DW80.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.74
MAAN-METHYLALANINED1D5X0.74
MAAN-METHYLALANINEC1PYW0.74
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.74
MAAN-METHYLALANINEC,I2IE30.74
MAAN-METHYLALANINEC,F,X,Y2NPP0.74
NXAN-CARBOXYALANINEA2IUX0.78
NXAN-CARBOXYALANINEA1O8A0.78
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.77
DNGN-FORMYL-D-NORLEUCINEA,B1S4A0.72
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.72
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.72
AMEN-ACETYLMETHIONINEA,B2J4Y0.72
BAF(TERT-BUTYLOXYCARBONYL)-ALANYL-
AMINO ETHYL-FORMAMIDE
A1ELF0.74
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.77
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.71
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.71
C99{(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]-
2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN-
1-YL}ACETIC ACID
A2HCG0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.7
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.7
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.7
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.7
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.7
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.72
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.75
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.75
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.72
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.72
N10O-[(HEXYLAMINO)CARBONYL]-L-SERINEA,B,C,D,E,F,
G,H
2Q0S0.71
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
NSKN-SUCCINYL LYSINEA2P8B0.72
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.73
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.75
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.75
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.75
FMEN-FORMYLMETHIONINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.72
FMEN-FORMYLMETHIONINEA1DZA0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z
2ZXW0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.72
FMEN-FORMYLMETHIONINEC,H,L,M3PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M2PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M1R2C0.72
FMEN-FORMYLMETHIONINEA2W9N0.72
FMEN-FORMYLMETHIONINEA,B,D,E,G,H1KZU0.72
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.72
FMEN-FORMYLMETHIONINEC,H,L,M5PRC0.72
FMEN-FORMYLMETHIONINEA1BQ90.72
FMEN-FORMYLMETHIONINEA2BFR0.72
FMEN-FORMYLMETHIONINEC,D,F1MHC0.72
FMEN-FORMYLMETHIONINEA,B,C1Y4Z0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.72
FMEN-FORMYLMETHIONINEA,B1QX20.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,G1TG60.72
FMEN-FORMYLMETHIONINEA,B,C1Y5N0.72
FMEN-FORMYLMETHIONINEC,H,L,M2I5N0.72
FMEN-FORMYLMETHIONINEA2BFQ0.72
FMEN-FORMYLMETHIONINEA2KAM0.72
FMEN-FORMYLMETHIONINEA,B,C1SIW0.72
FMEN-FORMYLMETHIONINEC,D,I,L1LK60.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.72
FMEN-FORMYLMETHIONINEA1RB90.72
FMEN-FORMYLMETHIONINEC,H,L,M,U1DXR0.72
FMEN-FORMYLMETHIONINEA,B,C,D1DCE0.72
FMEN-FORMYLMETHIONINEC,H,L,M1PRC0.72
FMEN-FORMYLMETHIONINEA,B,C1Y5L0.72
FMEN-FORMYLMETHIONINEA,B,X,Y2G5L0.72
FMEN-FORMYLMETHIONINEA,B,C1Q160.72
FMEN-FORMYLMETHIONINEC,H,L,M2JBL0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,H
2H610.72
FMEN-FORMYLMETHIONINEC,H,L,M6PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M3D380.72
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.72
FMEN-FORMYLMETHIONINEC,D2FMT0.72
FMEN-FORMYLMETHIONINEA1Q7O0.72
FMEN-FORMYLMETHIONINEA,B3D0Y0.72
FMEN-FORMYLMETHIONINEA,B,C,D1V4G0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.72
FMEN-FORMYLMETHIONINEC,H,L,M7PRC0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F1IJD0.72
FMEN-FORMYLMETHIONINEC,H,L,M1VRN0.72
FMEN-FORMYLMETHIONINEA,B,C1Y5I0.72
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.7
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.78
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.8
SACN-ACETYL-SERINEA1R4U0.8
SACN-ACETYL-SERINEA,B,C,D1WS30.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.8
SACN-ACETYL-SERINEA,B1EVU0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.8
SACN-ACETYL-SERINEA1WRR0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.8
SACN-ACETYL-SERINEA,B3CVQ0.8
SACN-ACETYL-SERINEA1B0B0.8
SACN-ACETYL-SERINEA1XT40.8
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.8
SACN-ACETYL-SERINEA2FXL0.8
SACN-ACETYL-SERINEA1R4S0.8
SACN-ACETYL-SERINEA,B,C,D1WS20.8
SACN-ACETYL-SERINEA,B,C,D2AUC0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.8
SACN-ACETYL-SERINEA1R510.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.8
SACN-ACETYL-SERINEA,B,C,D1XXJ0.8
SACN-ACETYL-SERINET2QAC0.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.8
AYAN-ACETYLALANINEA1D0W0.83
AYAN-ACETYLALANINEA1AH40.83
AYAN-ACETYLALANINEA,B1VBP0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.83
AYAN-ACETYLALANINEA,B,C,D1OUW0.83
AYAN-ACETYLALANINEA1AH30.83
AYAN-ACETYLALANINEA1EKO0.83
AYAN-ACETYLALANINEB,D,F,H2V4I0.83
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.83
AYAN-ACETYLALANINEA,B,C,D1J4U0.83
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.73
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.72
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.72
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.72
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.76
THCN-METHYLCARBONYLTHREONINEB2HR00.76
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.76
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.76
CL5N-(3-OXOPROPYL)GLYCINEA2IOT0.7
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B,C,D,E,F,
G,H
1T6P0.76
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B1T6J0.76
IPGN-ISOPROPYL GLYCINEC,D2SEM0.72
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.71
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.71
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.73
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.75
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.73
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.79
AACACETYLAMINO-ACETIC ACIDA,B1NG30.72
AACACETYLAMINO-ACETIC ACIDA1QD80.72
ALYN(6)-ACETYLLYSINEA,B2B4D0.73
ALYN(6)-ACETYLLYSINEA,B2OD90.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.73
ALYN(6)-ACETYLLYSINEA,B2B5G0.73
ALYN(6)-ACETYLLYSINEA2GIV0.73
ALYN(6)-ACETYLLYSINEB2RNY0.73
ALYN(6)-ACETYLLYSINEA1JSP0.73
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.73
ALYN(6)-ACETYLLYSINEA,D3D4B0.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.73
ALYN(6)-ACETYLLYSINEA,B2R0Y0.73
ALYN(6)-ACETYLLYSINEA3CZ70.73
ALYN(6)-ACETYLLYSINEA1JM40.73
ALYN(6)-ACETYLLYSINEA,B2H4H0.73
ALYN(6)-ACETYLLYSINEA,B2J6V0.73
ALYN(6)-ACETYLLYSINEA,B2R100.73
ALYN(6)-ACETYLLYSINEA,B1YC50.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.73
ALYN(6)-ACETYLLYSINEA,B2H2G0.73
ALYN(6)-ACETYLLYSINEA,D2H4F0.73
ALYN(6)-ACETYLLYSINEA2OU20.73
ALYN(6)-ACETYLLYSINEA,B1S5P0.73
ALYN(6)-ACETYLLYSINEB2RNW0.73
ALYN(6)-ACETYLLYSINEA3D350.73
ALYN(6)-ACETYLLYSINEA,B2OD20.73
ALYN(6)-ACETYLLYSINEA2ZFN0.73
ALYN(6)-ACETYLLYSINEC,D2C1J0.73
ALYN(6)-ACETYLLYSINEA,B2QQG0.73
ALYN(6)-ACETYLLYSINEB2RNX0.73
ALYN(6)-ACETYLLYSINEA,B1MA30.73
ALYN(6)-ACETYLLYSINEA,B2H2H0.73
ALYN(6)-ACETYLLYSINEA2I2Z0.73
ALYN(6)-ACETYLLYSINEA,B2OD70.73
ALYN(6)-ACETYLLYSINEP1E6I0.73
ALYN(6)-ACETYLLYSINEA,B1SZC0.73
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.73
ALYN(6)-ACETYLLYSINEA,B2H2D0.73
ALYN(6)-ACETYLLYSINEA,B1Q1A0.73
ALYN(6)-ACETYLLYSINEA,B1SZD0.73
ALYN(6)-ACETYLLYSINEQ,R2E3K0.73
ALYN(6)-ACETYLLYSINEA2OZU0.73
ALYN(6)-ACETYLLYSINEA,B2QQF0.73
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.73
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.78
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77
C6LN-hexanoyl-L-homoserineA3DHA0.75
C6LN-hexanoyl-L-homoserineA3DHB0.75
BAA(TERT-BUTYLOXYCARBONYL)-ALANYL-
ALANYL-AMINE
A1ELG0.77
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75
CYKN-hexanoyl-L-homocysteineA3DHC0.71