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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201531

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.7
APP1-ACETYL-2-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.73
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.71
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.71
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.71
BEQN-(CARBOXYMETHYL)-N,N-DIMETHYL-
3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT
A,B,C,D1YBK0.76
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.79
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.79
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.75
C6LN-hexanoyl-L-homoserineA3DHA0.78
C6LN-hexanoyl-L-homoserineA3DHB0.78
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.7
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.78
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1ODM0.73
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1OBN0.73
ASVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-VINYLGLYCINE
A1OC10.73
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B1BY50.71
AHON-ACETYL-N-HYDROXY-L-ORNITHINEA,B,C2W6U0.71
ALYN(6)-ACETYLLYSINEA,B2B4D0.85
ALYN(6)-ACETYLLYSINEA,B2OD90.85
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.85
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.85
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.85
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.85
ALYN(6)-ACETYLLYSINEA,B2B5G0.85
ALYN(6)-ACETYLLYSINEA2GIV0.85
ALYN(6)-ACETYLLYSINEB2RNY0.85
ALYN(6)-ACETYLLYSINEA1JSP0.85
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.85
ALYN(6)-ACETYLLYSINEA,D3D4B0.85
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.85
ALYN(6)-ACETYLLYSINEA,B2R0Y0.85
ALYN(6)-ACETYLLYSINEA3CZ70.85
ALYN(6)-ACETYLLYSINEA1JM40.85
ALYN(6)-ACETYLLYSINEA,B2H4H0.85
ALYN(6)-ACETYLLYSINEA,B2J6V0.85
ALYN(6)-ACETYLLYSINEA,B2R100.85
ALYN(6)-ACETYLLYSINEA,B1YC50.85
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.85
ALYN(6)-ACETYLLYSINEA,B2H2G0.85
ALYN(6)-ACETYLLYSINEA,D2H4F0.85
ALYN(6)-ACETYLLYSINEA2OU20.85
ALYN(6)-ACETYLLYSINEA,B1S5P0.85
ALYN(6)-ACETYLLYSINEB2RNW0.85
ALYN(6)-ACETYLLYSINEA3D350.85
ALYN(6)-ACETYLLYSINEA,B2OD20.85
ALYN(6)-ACETYLLYSINEA2ZFN0.85
ALYN(6)-ACETYLLYSINEC,D2C1J0.85
ALYN(6)-ACETYLLYSINEA,B2QQG0.85
ALYN(6)-ACETYLLYSINEB2RNX0.85
ALYN(6)-ACETYLLYSINEA,B1MA30.85
ALYN(6)-ACETYLLYSINEA,B2H2H0.85
ALYN(6)-ACETYLLYSINEA2I2Z0.85
ALYN(6)-ACETYLLYSINEA,B2OD70.85
ALYN(6)-ACETYLLYSINEP1E6I0.85
ALYN(6)-ACETYLLYSINEA,B1SZC0.85
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.85
ALYN(6)-ACETYLLYSINEA,B2H2D0.85
ALYN(6)-ACETYLLYSINEA,B1Q1A0.85
ALYN(6)-ACETYLLYSINEA,B1SZD0.85
ALYN(6)-ACETYLLYSINEQ,R2E3K0.85
ALYN(6)-ACETYLLYSINEA2OZU0.85
ALYN(6)-ACETYLLYSINEA,B2QQF0.85
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.85
BUJ(3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoateA,B2RCU0.74
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.78
140N-PALMITOYLGLYCINEA,B1JPZ0.74
140N-PALMITOYLGLYCINEA,B1ZOA0.74
140N-PALMITOYLGLYCINEA,B3CBD0.74
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.77
AN0N-ACETYL-L-NORVALINEA1ZQ80.77
CCLN~6~-[(CYCLOPENTYLOXY)CARBONYL]-
D-LYSINE
A2Q7G0.74
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.78
3GCGAMMA-GLUTAMYLCYSTEINEA,B2BU30.71
3GCGAMMA-GLUTAMYLCYSTEINEA,B1M0W0.71