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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03133106

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.71
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.71
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.71
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.71
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.71
BUJ(3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoateA,B2RCU0.76
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
BUI(3R)-3-{[(TETRADECYLAMINO)CARBONYL]AMINO}-
4-(TRIMETHYLAMMONIO)BUTANOATE
A2FW30.72
NLGN-ACETYL-L-GLUTAMATEA1OH90.7
NLGN-ACETYL-L-GLUTAMATEA1OHA0.7
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.7
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.7
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.7
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.7
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.7
NLGN-ACETYL-L-GLUTAMATEA3B8G0.7
NLGN-ACETYL-L-GLUTAMATEA1GS50.7
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.7
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.79
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.72
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.72
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.78
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.78
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.71
AN0N-ACETYL-L-NORVALINEA1ZQ80.71
NC44-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACIDA1ZD30.78
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.75
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.74
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
1GH00.74
MENN-METHYL ASPARAGINEA,B,C,D1XF60.74
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.74
MENN-METHYL ASPARAGINEA,B1I7Y0.74
MENN-METHYL ASPARAGINEA,B3BRP0.74
MENN-METHYL ASPARAGINEA,B1JBO0.74
MENN-METHYL ASPARAGINEA,B1ALL0.74
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.74
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
1HA70.74
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.74
MENN-METHYL ASPARAGINEA,B1KTP0.74
MENN-METHYL ASPARAGINEA,B1PHN0.74
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.74
MENN-METHYL ASPARAGINEA,B,C,D1XG00.74
MENN-METHYL ASPARAGINEA,B2VJT0.74
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.74
MENN-METHYL ASPARAGINEA,B2V8A0.74
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.74
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.7
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.7
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.7
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.73
NSKN-SUCCINYL LYSINEA2P8B0.8
C6LN-hexanoyl-L-homoserineA3DHA0.72
C6LN-hexanoyl-L-homoserineA3DHB0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAG0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAF0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA,B,C,D3FMF0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAI0.72
ALYN(6)-ACETYLLYSINEA,B2B4D0.77
ALYN(6)-ACETYLLYSINEA,B2OD90.77
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.77
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.77
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.77
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.77
ALYN(6)-ACETYLLYSINEA,B2B5G0.77
ALYN(6)-ACETYLLYSINEA2GIV0.77
ALYN(6)-ACETYLLYSINEB2RNY0.77
ALYN(6)-ACETYLLYSINEA1JSP0.77
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.77
ALYN(6)-ACETYLLYSINEA,D3D4B0.77
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.77
ALYN(6)-ACETYLLYSINEA,B2R0Y0.77
ALYN(6)-ACETYLLYSINEA3CZ70.77
ALYN(6)-ACETYLLYSINEA1JM40.77
ALYN(6)-ACETYLLYSINEA,B2H4H0.77
ALYN(6)-ACETYLLYSINEA,B2J6V0.77
ALYN(6)-ACETYLLYSINEA,B2R100.77
ALYN(6)-ACETYLLYSINEA,B1YC50.77
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.77
ALYN(6)-ACETYLLYSINEA,B2H2G0.77
ALYN(6)-ACETYLLYSINEA,D2H4F0.77
ALYN(6)-ACETYLLYSINEA2OU20.77
ALYN(6)-ACETYLLYSINEA,B1S5P0.77
ALYN(6)-ACETYLLYSINEB2RNW0.77
ALYN(6)-ACETYLLYSINEA3D350.77
ALYN(6)-ACETYLLYSINEA,B2OD20.77
ALYN(6)-ACETYLLYSINEA2ZFN0.77
ALYN(6)-ACETYLLYSINEC,D2C1J0.77
ALYN(6)-ACETYLLYSINEA,B2QQG0.77
ALYN(6)-ACETYLLYSINEB2RNX0.77
ALYN(6)-ACETYLLYSINEA,B1MA30.77
ALYN(6)-ACETYLLYSINEA,B2H2H0.77
ALYN(6)-ACETYLLYSINEA2I2Z0.77
ALYN(6)-ACETYLLYSINEA,B2OD70.77
ALYN(6)-ACETYLLYSINEP1E6I0.77
ALYN(6)-ACETYLLYSINEA,B1SZC0.77
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.77
ALYN(6)-ACETYLLYSINEA,B2H2D0.77
ALYN(6)-ACETYLLYSINEA,B1Q1A0.77
ALYN(6)-ACETYLLYSINEA,B1SZD0.77
ALYN(6)-ACETYLLYSINEQ,R2E3K0.77
ALYN(6)-ACETYLLYSINEA2OZU0.77
ALYN(6)-ACETYLLYSINEA,B2QQF0.77
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.77
NC66-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}HEXANOIC ACIDA1ZD40.7
DAA8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDEA1BS10.7
140N-PALMITOYLGLYCINEA,B1JPZ0.74
140N-PALMITOYLGLYCINEA,B1ZOA0.74
140N-PALMITOYLGLYCINEA,B3CBD0.74
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CAY0.76
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CBA0.76
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.71
CYKN-hexanoyl-L-homocysteineA3DHC0.71