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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02269173

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHRN-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACIDA,B,C,D,E,F,
G,H
1E5Q0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.73
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.73
AYAN-ACETYLALANINEA1D0W0.74
AYAN-ACETYLALANINEA1AH40.74
AYAN-ACETYLALANINEA,B1VBP0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.74
AYAN-ACETYLALANINEA,B,C,D1OUW0.74
AYAN-ACETYLALANINEA1AH30.74
AYAN-ACETYLALANINEA1EKO0.74
AYAN-ACETYLALANINEB,D,F,H2V4I0.74
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.74
AYAN-ACETYLALANINEA,B,C,D1J4U0.74
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.73
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.73
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.73
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.73
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.73
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.72
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.72
MVAN-METHYLVALINEA209D0.73
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H
3BO70.73
MVAN-METHYLVALINEC1CWH0.73
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
1UNJ0.73
MVAN-METHYLVALINEA1DSD0.73
MVAN-METHYLVALINEB1L1V0.73
MVAN-METHYLVALINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.73
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMB0.73
MVAN-METHYLVALINEC1CWO0.73
MVAN-METHYLVALINEC1CWL0.73
MVAN-METHYLVALINEB1MIK0.73
MVAN-METHYLVALINEA1CSA0.73
MVAN-METHYLVALINEC1CWM0.73
MVAN-METHYLVALINEA1PFE0.73
MVAN-METHYLVALINEA,B,D,E,F,H1M630.73
MVAN-METHYLVALINEC1CWC0.73
MVAN-METHYLVALINEB,D,F,H2RMC0.73
MVAN-METHYLVALINEC1CWK0.73
MVAN-METHYLVALINEC1CYN0.73
MVAN-METHYLVALINEC,D1MNV0.73
MVAN-METHYLVALINEC,D2OJU0.73
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMA0.73
MVAN-METHYLVALINEA1CYB0.73
MVAN-METHYLVALINED1QNG0.73
MVAN-METHYLVALINEA,C,E,G2ADW0.73
MVAN-METHYLVALINEC1CWB0.73
MVAN-METHYLVALINEA,B,C,D,E,F1UNM0.73
MVAN-METHYLVALINEA,B1OVF0.73
MVAN-METHYLVALINEA,B185D0.73
MVAN-METHYLVALINEA1XVK0.73
MVAN-METHYLVALINEA,C1XVR0.73
MVAN-METHYLVALINEA,B173D0.73
MVAN-METHYLVALINEA,B1FJA0.73
MVAN-METHYLVALINEB3CYS0.73
MVAN-METHYLVALINEA,B,C1A7Y0.73
MVAN-METHYLVALINEA,B,C1L5G0.73
MVAN-METHYLVALINEA,B,C,D1I3W0.73
MVAN-METHYLVALINEA316D0.73
MVAN-METHYLVALINEA1XVN0.73
MVAN-METHYLVALINEC1IKF0.73
MVAN-METHYLVALINEA,M,N2Z6W0.73
MVAN-METHYLVALINEA,B,C1QFI0.73
MVAN-METHYLVALINEA,B3GO30.73
MVAN-METHYLVALINEC1CWA0.73
MVAN-METHYLVALINEC1CWF0.73
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P
1C5F0.73
MVAN-METHYLVALINED,E,F1XQ70.73
MVAN-METHYLVALINEA1CYA0.73
MVAN-METHYLVALINEA,B,D1MF80.73
MVAN-METHYLVALINEA,B1A7Z0.73
MVAN-METHYLVALINEA1DSC0.73
MVAN-METHYLVALINET,U,V2POY0.73
MVAN-METHYLVALINEA2D550.73
MVAN-METHYLVALINEC1BCK0.73
MVAN-METHYLVALINEC1CWI0.73
MVAN-METHYLVALINEC,D1QNH0.73
MVAN-METHYLVALINEA1VS20.73
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
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.73
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.73
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.73
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.73
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.73
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.73
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.73
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.73
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.73
AFAN-[7-METHYL-OCT-2,4-DIENOYL]ASPARAGINEA1DSR0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.76
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.82
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.84
DSGD-ASPARAGINEA,B2Q330.82
DSGD-ASPARAGINEA2IH00.82
DSGD-ASPARAGINEA2JUE0.82
DSGD-ASPARAGINEA1A850.82
DSGD-ASPARAGINEA1T5N0.82
DSGD-ASPARAGINEA2IGZ0.82
DSGD-ASPARAGINEA,B,C,D3BOG0.82
DSGD-ASPARAGINEA1T5M0.82
DSGD-ASPARAGINEA,B1HXB0.82
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.89
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
1GH00.89
MENN-METHYL ASPARAGINEA,B,C,D1XF60.89
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.89
MENN-METHYL ASPARAGINEA,B1I7Y0.89
MENN-METHYL ASPARAGINEA,B3BRP0.89
MENN-METHYL ASPARAGINEA,B1JBO0.89
MENN-METHYL ASPARAGINEA,B1ALL0.89
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.89
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
1HA70.89
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.89
MENN-METHYL ASPARAGINEA,B1KTP0.89
MENN-METHYL ASPARAGINEA,B1PHN0.89
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.89
MENN-METHYL ASPARAGINEA,B,C,D1XG00.89
MENN-METHYL ASPARAGINEA,B2VJT0.89
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.89
MENN-METHYL ASPARAGINEA,B2V8A0.89
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.89
NLGN-ACETYL-L-GLUTAMATEA1OH90.75
NLGN-ACETYL-L-GLUTAMATEA1OHA0.75
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.75
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.75
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.75
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.75
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.75
NLGN-ACETYL-L-GLUTAMATEA3B8G0.75
NLGN-ACETYL-L-GLUTAMATEA1GS50.75
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.75
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.7
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.78
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.86
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.86
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.86
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.86
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.86
NSKN-SUCCINYL LYSINEA2P8B0.8
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.7
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.73
1IPN~2~-(PHOSPHONOACETYL)-L-ASPARAGINEA,B,C,D2IPO0.8
C6LN-hexanoyl-L-homoserineA3DHA0.72
C6LN-hexanoyl-L-homoserineA3DHB0.72
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.71
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.75
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.75
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.75
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77
LYPN~6~-METHYL-N~6~-PROPYL-L-LYSINEA,E2UXN0.7
6PR(S)-4-AMINO-4-OXO-3-(2-PHOSPHONOACETAMIDO)BUTANOIC ACIDA,B,C,D2H3E0.72
ALYN(6)-ACETYLLYSINEA,B2B4D0.74
ALYN(6)-ACETYLLYSINEA,B2OD90.74
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.74
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.74
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.74
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.74
ALYN(6)-ACETYLLYSINEA,B2B5G0.74
ALYN(6)-ACETYLLYSINEA2GIV0.74
ALYN(6)-ACETYLLYSINEB2RNY0.74
ALYN(6)-ACETYLLYSINEA1JSP0.74
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.74
ALYN(6)-ACETYLLYSINEA,D3D4B0.74
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.74
ALYN(6)-ACETYLLYSINEA,B2R0Y0.74
ALYN(6)-ACETYLLYSINEA3CZ70.74
ALYN(6)-ACETYLLYSINEA1JM40.74
ALYN(6)-ACETYLLYSINEA,B2H4H0.74
ALYN(6)-ACETYLLYSINEA,B2J6V0.74
ALYN(6)-ACETYLLYSINEA,B2R100.74
ALYN(6)-ACETYLLYSINEA,B1YC50.74
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.74
ALYN(6)-ACETYLLYSINEA,B2H2G0.74
ALYN(6)-ACETYLLYSINEA,D2H4F0.74
ALYN(6)-ACETYLLYSINEA2OU20.74
ALYN(6)-ACETYLLYSINEA,B1S5P0.74
ALYN(6)-ACETYLLYSINEB2RNW0.74
ALYN(6)-ACETYLLYSINEA3D350.74
ALYN(6)-ACETYLLYSINEA,B2OD20.74
ALYN(6)-ACETYLLYSINEA2ZFN0.74
ALYN(6)-ACETYLLYSINEC,D2C1J0.74
ALYN(6)-ACETYLLYSINEA,B2QQG0.74
ALYN(6)-ACETYLLYSINEB2RNX0.74
ALYN(6)-ACETYLLYSINEA,B1MA30.74
ALYN(6)-ACETYLLYSINEA,B2H2H0.74
ALYN(6)-ACETYLLYSINEA2I2Z0.74
ALYN(6)-ACETYLLYSINEA,B2OD70.74
ALYN(6)-ACETYLLYSINEP1E6I0.74
ALYN(6)-ACETYLLYSINEA,B1SZC0.74
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.74
ALYN(6)-ACETYLLYSINEA,B2H2D0.74
ALYN(6)-ACETYLLYSINEA,B1Q1A0.74
ALYN(6)-ACETYLLYSINEA,B1SZD0.74
ALYN(6)-ACETYLLYSINEQ,R2E3K0.74
ALYN(6)-ACETYLLYSINEA2OZU0.74
ALYN(6)-ACETYLLYSINEA,B2QQF0.74
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.74
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75
CYKN-hexanoyl-L-homocysteineA3DHC0.71
MAAN-METHYLALANINEA,B1A7Z0.71
MAAN-METHYLALANINEA,B2VSL0.71
MAAN-METHYLALANINEC1CWI0.71
MAAN-METHYLALANINEC,F,G,H3DW80.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.71
MAAN-METHYLALANINED1D5X0.71
MAAN-METHYLALANINEC1PYW0.71
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.71
MAAN-METHYLALANINEC,I2IE30.71
MAAN-METHYLALANINEC,F,X,Y2NPP0.71