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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201573

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.72
CPI6-CARBOXYPIPERIDINEB1EOL0.72
CPI6-CARBOXYPIPERIDINEB1EOJ0.72
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.72
CPI6-CARBOXYPIPERIDINEA,B2ITK0.72
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.72
CCLN~6~-[(CYCLOPENTYLOXY)CARBONYL]-
D-LYSINE
A2Q7G0.81
193(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACIDA1XY50.7
ALYN(6)-ACETYLLYSINEA,B2B4D0.81
ALYN(6)-ACETYLLYSINEA,B2OD90.81
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.81
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.81
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.81
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.81
ALYN(6)-ACETYLLYSINEA,B2B5G0.81
ALYN(6)-ACETYLLYSINEA2GIV0.81
ALYN(6)-ACETYLLYSINEB2RNY0.81
ALYN(6)-ACETYLLYSINEA1JSP0.81
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.81
ALYN(6)-ACETYLLYSINEA,D3D4B0.81
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.81
ALYN(6)-ACETYLLYSINEA,B2R0Y0.81
ALYN(6)-ACETYLLYSINEA3CZ70.81
ALYN(6)-ACETYLLYSINEA1JM40.81
ALYN(6)-ACETYLLYSINEA,B2H4H0.81
ALYN(6)-ACETYLLYSINEA,B2J6V0.81
ALYN(6)-ACETYLLYSINEA,B2R100.81
ALYN(6)-ACETYLLYSINEA,B1YC50.81
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.81
ALYN(6)-ACETYLLYSINEA,B2H2G0.81
ALYN(6)-ACETYLLYSINEA,D2H4F0.81
ALYN(6)-ACETYLLYSINEA2OU20.81
ALYN(6)-ACETYLLYSINEA,B1S5P0.81
ALYN(6)-ACETYLLYSINEB2RNW0.81
ALYN(6)-ACETYLLYSINEA3D350.81
ALYN(6)-ACETYLLYSINEA,B2OD20.81
ALYN(6)-ACETYLLYSINEA2ZFN0.81
ALYN(6)-ACETYLLYSINEC,D2C1J0.81
ALYN(6)-ACETYLLYSINEA,B2QQG0.81
ALYN(6)-ACETYLLYSINEB2RNX0.81
ALYN(6)-ACETYLLYSINEA,B1MA30.81
ALYN(6)-ACETYLLYSINEA,B2H2H0.81
ALYN(6)-ACETYLLYSINEA2I2Z0.81
ALYN(6)-ACETYLLYSINEA,B2OD70.81
ALYN(6)-ACETYLLYSINEP1E6I0.81
ALYN(6)-ACETYLLYSINEA,B1SZC0.81
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.81
ALYN(6)-ACETYLLYSINEA,B2H2D0.81
ALYN(6)-ACETYLLYSINEA,B1Q1A0.81
ALYN(6)-ACETYLLYSINEA,B1SZD0.81
ALYN(6)-ACETYLLYSINEQ,R2E3K0.81
ALYN(6)-ACETYLLYSINEA2OZU0.81
ALYN(6)-ACETYLLYSINEA,B2QQF0.81
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.81
CYKN-hexanoyl-L-homocysteineA3DHC0.73
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.72
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.72
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.72
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.72
5FP5,5,5-TRIFLUORO-3-HYDROXY-4-[2-
(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-
METHYL-2-[3-METHYL-2-(3-METHYL-
BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-
PENTANOYLAMINO)-PROPIONYLAMINO]-
PENTANOIC ACID
A,B1XE60.72
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.71
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.72
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.71
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.83
ATIN-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACIDA1Y0Y0.81
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.74
AN0N-ACETYL-L-NORVALINEA1ZQ80.74
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.7
5FE5,5,5-TRIFLUORO-3-HYDROXY-4-[2-
(5,5,5-TRIFLUORO-3-HYDROXY-4-{3-
METHYL-2-[3-METHYL-2-(3-METHYL-
BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}-
PENTANOYLAMINO)-PROPIONYLAMINO]-
PENTANOIC ACID METHYL ESTER
A,B1XE50.72
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.85
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.71
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75
AR9(2R,4S)-N-butyl-4-[(2S,5S,7R)-2,7-
dimethyl-3,15-dioxo-1,4-diazacyclopentadecan-
5-yl]-4-hydroxy-2-methylbutanamide
A,B,C3DV10.7
C6LN-hexanoyl-L-homoserineA3DHA0.85
C6LN-hexanoyl-L-homoserineA3DHB0.85