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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02234674

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.74
NSKN-SUCCINYL LYSINEA2P8B0.73
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.72
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.71
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.74
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.74
AYAN-ACETYLALANINEA1D0W0.75
AYAN-ACETYLALANINEA1AH40.75
AYAN-ACETYLALANINEA,B1VBP0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.75
AYAN-ACETYLALANINEA,B,C,D1OUW0.75
AYAN-ACETYLALANINEA1AH30.75
AYAN-ACETYLALANINEA1EKO0.75
AYAN-ACETYLALANINEB,D,F,H2V4I0.75
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.75
AYAN-ACETYLALANINEA,B,C,D1J4U0.75
NXAN-CARBOXYALANINEA2IUX0.7
NXAN-CARBOXYALANINEA1O8A0.7
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.75
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.73
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.78
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.78
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.76
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.72
SACN-ACETYL-SERINEA1R4U0.72
SACN-ACETYL-SERINEA,B,C,D1WS30.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.72
SACN-ACETYL-SERINEA,B1EVU0.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.72
SACN-ACETYL-SERINEA1WRR0.72
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.72
SACN-ACETYL-SERINEA,B3CVQ0.72
SACN-ACETYL-SERINEA1B0B0.72
SACN-ACETYL-SERINEA1XT40.72
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.72
SACN-ACETYL-SERINEA2FXL0.72
SACN-ACETYL-SERINEA1R4S0.72
SACN-ACETYL-SERINEA,B,C,D1WS20.72
SACN-ACETYL-SERINEA,B,C,D2AUC0.72
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.72
SACN-ACETYL-SERINEA1R510.72
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.72
SACN-ACETYL-SERINEA,B,C,D1XXJ0.72
SACN-ACETYL-SERINET2QAC0.72
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.72
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.75
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
1GH00.75
MENN-METHYL ASPARAGINEA,B,C,D1XF60.75
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.75
MENN-METHYL ASPARAGINEA,B1I7Y0.75
MENN-METHYL ASPARAGINEA,B3BRP0.75
MENN-METHYL ASPARAGINEA,B1JBO0.75
MENN-METHYL ASPARAGINEA,B1ALL0.75
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.75
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
1HA70.75
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.75
MENN-METHYL ASPARAGINEA,B1KTP0.75
MENN-METHYL ASPARAGINEA,B1PHN0.75
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.75
MENN-METHYL ASPARAGINEA,B,C,D1XG00.75
MENN-METHYL ASPARAGINEA,B2VJT0.75
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.75
MENN-METHYL ASPARAGINEA,B2V8A0.75
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.75
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.75
THCN-METHYLCARBONYLTHREONINEB2HR00.75
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.75
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.75
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
ATIN-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACIDA1Y0Y0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.71
DNGN-FORMYL-D-NORLEUCINEA,B1S4A0.71
2Z9N-acetyl-L-alpha-aspartyl-L-alpha-
glutamyl-N-[(1R)-2-carboxy-1-formylethyl]-
L-valinamide
A,B3H1P0.7
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.75
AN0N-ACETYL-L-NORVALINEA1ZQ80.75
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.74
C6LN-hexanoyl-L-homoserineA3DHA0.78
C6LN-hexanoyl-L-homoserineA3DHB0.78
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.83
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.83
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.83
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.83
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.83
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.72
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.72
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.72
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.72
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.72
NLGN-ACETYL-L-GLUTAMATEA1OH90.71
NLGN-ACETYL-L-GLUTAMATEA1OHA0.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.71
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.71
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.71
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.71
NLGN-ACETYL-L-GLUTAMATEA3B8G0.71
NLGN-ACETYL-L-GLUTAMATEA1GS50.71
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.71
FMEN-FORMYLMETHIONINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.71
FMEN-FORMYLMETHIONINEA1DZA0.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z
2ZXW0.71
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.71
FMEN-FORMYLMETHIONINEC,H,L,M3PRC0.71
FMEN-FORMYLMETHIONINEC,H,L,M2PRC0.71
FMEN-FORMYLMETHIONINEC,H,L,M1R2C0.71
FMEN-FORMYLMETHIONINEA2W9N0.71
FMEN-FORMYLMETHIONINEA,B,D,E,G,H1KZU0.71
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.71
FMEN-FORMYLMETHIONINEC,H,L,M5PRC0.71
FMEN-FORMYLMETHIONINEA1BQ90.71
FMEN-FORMYLMETHIONINEA2BFR0.71
FMEN-FORMYLMETHIONINEC,D,F1MHC0.71
FMEN-FORMYLMETHIONINEA,B,C1Y4Z0.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.71
FMEN-FORMYLMETHIONINEA,B1QX20.71
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,G1TG60.71
FMEN-FORMYLMETHIONINEA,B,C1Y5N0.71
FMEN-FORMYLMETHIONINEC,H,L,M2I5N0.71
FMEN-FORMYLMETHIONINEA2BFQ0.71
FMEN-FORMYLMETHIONINEA2KAM0.71
FMEN-FORMYLMETHIONINEA,B,C1SIW0.71
FMEN-FORMYLMETHIONINEC,D,I,L1LK60.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.71
FMEN-FORMYLMETHIONINEA1RB90.71
FMEN-FORMYLMETHIONINEC,H,L,M,U1DXR0.71
FMEN-FORMYLMETHIONINEA,B,C,D1DCE0.71
FMEN-FORMYLMETHIONINEC,H,L,M1PRC0.71
FMEN-FORMYLMETHIONINEA,B,C1Y5L0.71
FMEN-FORMYLMETHIONINEA,B,X,Y2G5L0.71
FMEN-FORMYLMETHIONINEA,B,C1Q160.71
FMEN-FORMYLMETHIONINEC,H,L,M2JBL0.71
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,H
2H610.71
FMEN-FORMYLMETHIONINEC,H,L,M6PRC0.71
FMEN-FORMYLMETHIONINEC,H,L,M3D380.71
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.71
FMEN-FORMYLMETHIONINEC,D2FMT0.71
FMEN-FORMYLMETHIONINEA1Q7O0.71
FMEN-FORMYLMETHIONINEA,B3D0Y0.71
FMEN-FORMYLMETHIONINEA,B,C,D1V4G0.71
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.71
FMEN-FORMYLMETHIONINEC,H,L,M7PRC0.71
FMEN-FORMYLMETHIONINEA,B,C,D,E,F1IJD0.71
FMEN-FORMYLMETHIONINEC,H,L,M1VRN0.71
FMEN-FORMYLMETHIONINEA,B,C1Y5I0.71
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.73
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.74
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.73
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.79
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.79
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.79
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.79
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.79
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.79
1583-(2-MERCAPTO-ACETYLAMINO)-4-OXO-
PENTANOIC ACID
A,B1NME0.72
1583-(2-MERCAPTO-ACETYLAMINO)-4-OXO-
PENTANOIC ACID
A1RWK0.72
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.7