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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00008872

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.8
AN0N-ACETYL-L-NORVALINEA1ZQ80.8
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NKK0.76
DMHN4,N4-DIMETHYL-ASPARAGINEA,B,C,D,E,F,
G,H
1NJT0.76
DMHN4,N4-DIMETHYL-ASPARAGINEE,F,G,H1NJU0.76
DMHN4,N4-DIMETHYL-ASPARAGINEY,Z1JQ70.76
DMHN4,N4-DIMETHYL-ASPARAGINEC1NKM0.76
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.7
MEQN5-METHYLGLUTAMINEA,B1NV80.71
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.75
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.7
THCN-METHYLCARBONYLTHREONINEB2HR00.7
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.7
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.7
PT3N-PROPYL-TARTRAMIC ACIDA,B,C,D2HPA0.71
ABUGAMMA-AMINO-BUTANOIC ACIDE,I,J1M1A0.78
ABUGAMMA-AMINO-BUTANOIC ACIDD,I,J1M180.78
ABUGAMMA-AMINO-BUTANOIC ACIDA2OKK0.78
ABUGAMMA-AMINO-BUTANOIC ACIDI1QUR0.78
ABUGAMMA-AMINO-BUTANOIC ACIDE,I,J1M190.78
ABUGAMMA-AMINO-BUTANOIC ACIDA,B2OKJ0.78
ABUGAMMA-AMINO-BUTANOIC ACIDA,B1CGL0.78
ABUGAMMA-AMINO-BUTANOIC ACIDA6JDW0.78
ABUGAMMA-AMINO-BUTANOIC ACIDA,D,E,G,I,J1S320.78
ABUGAMMA-AMINO-BUTANOIC ACIDA,B2JT90.78
NLGN-ACETYL-L-GLUTAMATEA1OH90.78
NLGN-ACETYL-L-GLUTAMATEA1OHA0.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.78
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.78
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.78
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.78
NLGN-ACETYL-L-GLUTAMATEA3B8G0.78
NLGN-ACETYL-L-GLUTAMATEA1GS50.78
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.78
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
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.85
MN14-CARBOXYPIPERIDINEN1NLO0.74
MN14-CARBOXYPIPERIDINEN1NLP0.74
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8V0.73
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2FVM0.73
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8H0.73
AACACETYLAMINO-ACETIC ACIDA,B1NG30.71
AACACETYLAMINO-ACETIC ACIDA1QD80.71
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
GVEMETHYL 4-AMINOBUTANOATEA,B,C,D2J7Q0.7
GVEMETHYL 4-AMINOBUTANOATEA,B,C,D1XD30.7
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.74
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
NC44-{[(CYCLOHEXYLAMINO)CARBONYL]AMINO}BUTANOIC ACIDA1ZD30.71
AYAN-ACETYLALANINEA1D0W0.76
AYAN-ACETYLALANINEA1AH40.76
AYAN-ACETYLALANINEA,B1VBP0.76
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.76
AYAN-ACETYLALANINEA,B,C,D1OUW0.76
AYAN-ACETYLALANINEA1AH30.76
AYAN-ACETYLALANINEA1EKO0.76
AYAN-ACETYLALANINEB,D,F,H2V4I0.76
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.76
AYAN-ACETYLALANINEA,B,C,D1J4U0.76
MENN-METHYL ASPARAGINEA,B,K,L1B8D0.8
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
1GH00.8
MENN-METHYL ASPARAGINEA,B,C,D1XF60.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
H,I,J,K,L,M
1B330.8
MENN-METHYL ASPARAGINEA,B1I7Y0.8
MENN-METHYL ASPARAGINEA,B3BRP0.8
MENN-METHYL ASPARAGINEA,B1JBO0.8
MENN-METHYL ASPARAGINEA,B1ALL0.8
MENN-METHYL ASPARAGINEA,B,K,L1EYX0.8
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
1HA70.8
MENN-METHYL ASPARAGINEA,B,C,D2VJH0.8
MENN-METHYL ASPARAGINEA,B1KTP0.8
MENN-METHYL ASPARAGINEA,B1PHN0.8
MENN-METHYL ASPARAGINEA,B,C,D1QGW0.8
MENN-METHYL ASPARAGINEA,B,C,D1XG00.8
MENN-METHYL ASPARAGINEA,B2VJT0.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.8
MENN-METHYL ASPARAGINEA,B2V8A0.8
MENN-METHYL ASPARAGINEA,B,C,D,E,F,
G,H
3DBJ0.8
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.72
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.72
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.71