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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00727841

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MVAN-METHYLVALINEA209D0.74
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H
3BO70.74
MVAN-METHYLVALINEC1CWH0.74
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.74
MVAN-METHYLVALINEA1DSD0.74
MVAN-METHYLVALINEB1L1V0.74
MVAN-METHYLVALINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.74
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMB0.74
MVAN-METHYLVALINEC1CWO0.74
MVAN-METHYLVALINEC1CWL0.74
MVAN-METHYLVALINEB1MIK0.74
MVAN-METHYLVALINEA1CSA0.74
MVAN-METHYLVALINEC1CWM0.74
MVAN-METHYLVALINEA1PFE0.74
MVAN-METHYLVALINEA,B,D,E,F,H1M630.74
MVAN-METHYLVALINEC1CWC0.74
MVAN-METHYLVALINEB,D,F,H2RMC0.74
MVAN-METHYLVALINEC1CWK0.74
MVAN-METHYLVALINEC1CYN0.74
MVAN-METHYLVALINEC,D1MNV0.74
MVAN-METHYLVALINEC,D2OJU0.74
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMA0.74
MVAN-METHYLVALINEA1CYB0.74
MVAN-METHYLVALINED1QNG0.74
MVAN-METHYLVALINEA,C,E,G2ADW0.74
MVAN-METHYLVALINEC1CWB0.74
MVAN-METHYLVALINEA,B,C,D,E,F1UNM0.74
MVAN-METHYLVALINEA,B1OVF0.74
MVAN-METHYLVALINEA,B185D0.74
MVAN-METHYLVALINEA1XVK0.74
MVAN-METHYLVALINEA,C1XVR0.74
MVAN-METHYLVALINEA,B173D0.74
MVAN-METHYLVALINEA,B1FJA0.74
MVAN-METHYLVALINEB3CYS0.74
MVAN-METHYLVALINEA,B,C1A7Y0.74
MVAN-METHYLVALINEA,B,C1L5G0.74
MVAN-METHYLVALINEA,B,C,D1I3W0.74
MVAN-METHYLVALINEA316D0.74
MVAN-METHYLVALINEA1XVN0.74
MVAN-METHYLVALINEC1IKF0.74
MVAN-METHYLVALINEA,M,N2Z6W0.74
MVAN-METHYLVALINEA,B,C1QFI0.74
MVAN-METHYLVALINEA,B3GO30.74
MVAN-METHYLVALINEC1CWA0.74
MVAN-METHYLVALINEC1CWF0.74
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P
1C5F0.74
MVAN-METHYLVALINED,E,F1XQ70.74
MVAN-METHYLVALINEA1CYA0.74
MVAN-METHYLVALINEA,B,D1MF80.74
MVAN-METHYLVALINEA,B1A7Z0.74
MVAN-METHYLVALINEA1DSC0.74
MVAN-METHYLVALINET,U,V2POY0.74
MVAN-METHYLVALINEA2D550.74
MVAN-METHYLVALINEC1BCK0.74
MVAN-METHYLVALINEC1CWI0.74
MVAN-METHYLVALINEC,D1QNH0.74
MVAN-METHYLVALINEA1VS20.74
AFAN-[7-METHYL-OCT-2,4-DIENOYL]ASPARAGINEA1DSR0.75
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.72
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
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.76
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C1EKX0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1Q950.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1TTH0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1ACM0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1D090.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1XJW0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA1ML40.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDB,D1I5O0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D1F1B0.7
PALN-(PHOSPHONACETYL)-L-ASPARTIC ACIDA,B,C,D8ATC0.7
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.84
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.84
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.74
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.74
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.74
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.74
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.73
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.73
CYKN-hexanoyl-L-homocysteineA3DHC0.72
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.85
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.72
IMLN-METHYL-ISOLEUCINEC1CWM0.71
RGS4N-MALONYL-CYSTEINYL-2,4-DIAMINOBUTYRATE DISULFIDEA4GR10.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.76
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.82
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.72
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA,B,D,E,F3FDM0.7
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3HF00.7
XPC(3S,4R)-4-aminopyrrolidine-3-carboxylic acidA3C3H0.7
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.78
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.74
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.74
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.74
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.73
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.71
OPIPANTOTHENYL-AMINOETHANOL-11-PIVALIC ACIDA,B,C,D2VU10.71
2Z9N-acetyl-L-alpha-aspartyl-L-alpha-
glutamyl-N-[(1R)-2-carboxy-1-formylethyl]-
L-valinamide
A,B3H1P0.7
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.77
DSGD-ASPARAGINEA,B2Q330.77
DSGD-ASPARAGINEA2IH00.77
DSGD-ASPARAGINEA2JUE0.77
DSGD-ASPARAGINEA1A850.77
DSGD-ASPARAGINEA1T5N0.77
DSGD-ASPARAGINEA2IGZ0.77
DSGD-ASPARAGINEA,B,C,D3BOG0.77
DSGD-ASPARAGINEA1T5M0.77
DSGD-ASPARAGINEA,B1HXB0.77
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.76
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.76
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.87
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
1GH00.87
MENN-METHYL ASPARAGINEA,B,C,D1XF60.87
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.87
MENN-METHYL ASPARAGINEA,B1I7Y0.87
MENN-METHYL ASPARAGINEA,B3BRP0.87
MENN-METHYL ASPARAGINEA,B1JBO0.87
MENN-METHYL ASPARAGINEA,B1ALL0.87
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.87
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
1HA70.87
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.87
MENN-METHYL ASPARAGINEA,B1KTP0.87
MENN-METHYL ASPARAGINEA,B1PHN0.87
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.87
MENN-METHYL ASPARAGINEA,B,C,D1XG00.87
MENN-METHYL ASPARAGINEA,B2VJT0.87
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.87
MENN-METHYL ASPARAGINEA,B2V8A0.87
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.87
NLGN-ACETYL-L-GLUTAMATEA1OH90.76
NLGN-ACETYL-L-GLUTAMATEA1OHA0.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.76
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.76
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.76
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.76
NLGN-ACETYL-L-GLUTAMATEA3B8G0.76
NLGN-ACETYL-L-GLUTAMATEA1GS50.76
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.76
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.74
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.74
NSKN-SUCCINYL LYSINEA2P8B0.81
ALYN(6)-ACETYLLYSINEA,B2B4D0.75
ALYN(6)-ACETYLLYSINEA,B2OD90.75
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.75
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.75
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.75
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.75
ALYN(6)-ACETYLLYSINEA,B2B5G0.75
ALYN(6)-ACETYLLYSINEA2GIV0.75
ALYN(6)-ACETYLLYSINEB2RNY0.75
ALYN(6)-ACETYLLYSINEA1JSP0.75
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.75
ALYN(6)-ACETYLLYSINEA,D3D4B0.75
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.75
ALYN(6)-ACETYLLYSINEA,B2R0Y0.75
ALYN(6)-ACETYLLYSINEA3CZ70.75
ALYN(6)-ACETYLLYSINEA1JM40.75
ALYN(6)-ACETYLLYSINEA,B2H4H0.75
ALYN(6)-ACETYLLYSINEA,B2J6V0.75
ALYN(6)-ACETYLLYSINEA,B2R100.75
ALYN(6)-ACETYLLYSINEA,B1YC50.75
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.75
ALYN(6)-ACETYLLYSINEA,B2H2G0.75
ALYN(6)-ACETYLLYSINEA,D2H4F0.75
ALYN(6)-ACETYLLYSINEA2OU20.75
ALYN(6)-ACETYLLYSINEA,B1S5P0.75
ALYN(6)-ACETYLLYSINEB2RNW0.75
ALYN(6)-ACETYLLYSINEA3D350.75
ALYN(6)-ACETYLLYSINEA,B2OD20.75
ALYN(6)-ACETYLLYSINEA2ZFN0.75
ALYN(6)-ACETYLLYSINEC,D2C1J0.75
ALYN(6)-ACETYLLYSINEA,B2QQG0.75
ALYN(6)-ACETYLLYSINEB2RNX0.75
ALYN(6)-ACETYLLYSINEA,B1MA30.75
ALYN(6)-ACETYLLYSINEA,B2H2H0.75
ALYN(6)-ACETYLLYSINEA2I2Z0.75
ALYN(6)-ACETYLLYSINEA,B2OD70.75
ALYN(6)-ACETYLLYSINEP1E6I0.75
ALYN(6)-ACETYLLYSINEA,B1SZC0.75
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.75
ALYN(6)-ACETYLLYSINEA,B2H2D0.75
ALYN(6)-ACETYLLYSINEA,B1Q1A0.75
ALYN(6)-ACETYLLYSINEA,B1SZD0.75
ALYN(6)-ACETYLLYSINEQ,R2E3K0.75
ALYN(6)-ACETYLLYSINEA2OZU0.75
ALYN(6)-ACETYLLYSINEA,B2QQF0.75
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.75
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.81
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.78
AN0N-ACETYL-L-NORVALINEA1ZQ80.78
MLEN-METHYLLEUCINEA,D2J9A0.71
MLEN-METHYLLEUCINEC1IKF0.71
MLEN-METHYLLEUCINEA,M,N2Z6W0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.71
MLEN-METHYLLEUCINED,E,F1XQ70.71
MLEN-METHYLLEUCINEC1CWA0.71
MLEN-METHYLLEUCINEC1CWF0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.71
MLEN-METHYLLEUCINEB3CYS0.71
MLEN-METHYLLEUCINEC1CWH0.71
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.71
MLEN-METHYLLEUCINEC1CYN0.71
MLEN-METHYLLEUCINEA1LV90.71
MLEN-METHYLLEUCINEC,D2OJU0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.71
MLEN-METHYLLEUCINEA1IKM0.71
MLEN-METHYLLEUCINEC1CWK0.71
MLEN-METHYLLEUCINEA,B2HG80.71
MLEN-METHYLLEUCINEC1CWB0.71
MLEN-METHYLLEUCINEC1CWJ0.71
MLEN-METHYLLEUCINEA1CYB0.71
MLEN-METHYLLEUCINED1QNG0.71
MLEN-METHYLLEUCINEB1MIK0.71
MLEN-METHYLLEUCINEA1CSA0.71
MLEN-METHYLLEUCINEC1CWL0.71
MLEN-METHYLLEUCINEA1CYA0.71
MLEN-METHYLLEUCINEA,B,D1MF80.71
MLEN-METHYLLEUCINEC1BCK0.71
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.71
MLEN-METHYLLEUCINEC1CWC0.71
MLEN-METHYLLEUCINEC1CWI0.71
MLEN-METHYLLEUCINEC,D1QNH0.71
MLEN-METHYLLEUCINEB,D,F,H2RMC0.71
MLEN-METHYLLEUCINEC1CWM0.71
MLEN-METHYLLEUCINET,U,V2POY0.71
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.71
MLEN-METHYLLEUCINEC1CWO0.71
MLEN-METHYLLEUCINEA1IKL0.71
C6LN-hexanoyl-L-homoserineA3DHA0.73
C6LN-hexanoyl-L-homoserineA3DHB0.73
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.84
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.84
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.84
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.84
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.84
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.71