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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00925972

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ALYN(6)-ACETYLLYSINEA,B2B4D0.71
ALYN(6)-ACETYLLYSINEA,B2OD90.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.71
ALYN(6)-ACETYLLYSINEA,B2B5G0.71
ALYN(6)-ACETYLLYSINEA2GIV0.71
ALYN(6)-ACETYLLYSINEB2RNY0.71
ALYN(6)-ACETYLLYSINEA1JSP0.71
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.71
ALYN(6)-ACETYLLYSINEA,D3D4B0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.71
ALYN(6)-ACETYLLYSINEA,B2R0Y0.71
ALYN(6)-ACETYLLYSINEA3CZ70.71
ALYN(6)-ACETYLLYSINEA1JM40.71
ALYN(6)-ACETYLLYSINEA,B2H4H0.71
ALYN(6)-ACETYLLYSINEA,B2J6V0.71
ALYN(6)-ACETYLLYSINEA,B2R100.71
ALYN(6)-ACETYLLYSINEA,B1YC50.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.71
ALYN(6)-ACETYLLYSINEA,B2H2G0.71
ALYN(6)-ACETYLLYSINEA,D2H4F0.71
ALYN(6)-ACETYLLYSINEA2OU20.71
ALYN(6)-ACETYLLYSINEA,B1S5P0.71
ALYN(6)-ACETYLLYSINEB2RNW0.71
ALYN(6)-ACETYLLYSINEA3D350.71
ALYN(6)-ACETYLLYSINEA,B2OD20.71
ALYN(6)-ACETYLLYSINEA2ZFN0.71
ALYN(6)-ACETYLLYSINEC,D2C1J0.71
ALYN(6)-ACETYLLYSINEA,B2QQG0.71
ALYN(6)-ACETYLLYSINEB2RNX0.71
ALYN(6)-ACETYLLYSINEA,B1MA30.71
ALYN(6)-ACETYLLYSINEA,B2H2H0.71
ALYN(6)-ACETYLLYSINEA2I2Z0.71
ALYN(6)-ACETYLLYSINEA,B2OD70.71
ALYN(6)-ACETYLLYSINEP1E6I0.71
ALYN(6)-ACETYLLYSINEA,B1SZC0.71
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.71
ALYN(6)-ACETYLLYSINEA,B2H2D0.71
ALYN(6)-ACETYLLYSINEA,B1Q1A0.71
ALYN(6)-ACETYLLYSINEA,B1SZD0.71
ALYN(6)-ACETYLLYSINEQ,R2E3K0.71
ALYN(6)-ACETYLLYSINEA2OZU0.71
ALYN(6)-ACETYLLYSINEA,B2QQF0.71
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.71
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.75
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.78
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.78
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.78
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.78
SMGN-SUCCINYL METHIONINEA,B,C,D1SJC0.74
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.73
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.73
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.74
140N-PALMITOYLGLYCINEA,B1JPZ0.71
140N-PALMITOYLGLYCINEA,B1ZOA0.71
140N-PALMITOYLGLYCINEA,B3CBD0.71
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.74
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.74
IP1ISOPENICILLIN NA1QJE0.7
HT5(4S)-4-(decanoylamino)-5-hydroxy-
3,4-dihydro-2H-thiophenium
A,B,C,D2VC70.77
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.73
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.77
AMEN-ACETYLMETHIONINEA,B2J4Y0.77
CDT4-METHYLSULFANYL-2-UREIDO-BUTYRIC ACIDA,B1UF50.7
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
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.76
CXMN-CARBOXYMETHIONINEA,B1DNA0.72
CXMN-CARBOXYMETHIONINEA,B1JTU0.72
CXMN-CARBOXYMETHIONINEA,B1F4F0.72
CXMN-CARBOXYMETHIONINEA,B3BHL0.72
CXMN-CARBOXYMETHIONINEA,B2G8M0.72
CXMN-CARBOXYMETHIONINEA,C1S3T0.72
CXMN-CARBOXYMETHIONINEA2FTN0.72
CXMN-CARBOXYMETHIONINEA1AJM0.72
CXMN-CARBOXYMETHIONINEA1EV80.72
CXMN-CARBOXYMETHIONINEA,B2G8O0.72
CXMN-CARBOXYMETHIONINEA1EV50.72
CXMN-CARBOXYMETHIONINEA,B1JG00.72
CXMN-CARBOXYMETHIONINEA1FFL0.72
CXMN-CARBOXYMETHIONINEA1BJG0.72
CXMN-CARBOXYMETHIONINEA,B1TLS0.72
CXMN-CARBOXYMETHIONINEA,B1KCE0.72
CXMN-CARBOXYMETHIONINEA,B1NCE0.72
CXMN-CARBOXYMETHIONINEA1TSN0.72
CXMN-CARBOXYMETHIONINEA1F4B0.72
CXMN-CARBOXYMETHIONINEA,B1F4G0.72
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F1KZJ0.72
CXMN-CARBOXYMETHIONINEA3B9H0.72
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F1NKZ0.72
CXMN-CARBOXYMETHIONINEA3BHR0.72
CXMN-CARBOXYMETHIONINEA,B1KZI0.72
CXMN-CARBOXYMETHIONINEA1EVG0.72
CXMN-CARBOXYMETHIONINEA,B1F4C0.72
CXMN-CARBOXYMETHIONINEA,B1FWM0.72
CXMN-CARBOXYMETHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,R,S
2FKW0.72
CXMN-CARBOXYMETHIONINEA1EVF0.72
CXMN-CARBOXYMETHIONINEA,B1F4D0.72
CXMN-CARBOXYMETHIONINEA,B1JUT0.72
CXMN-CARBOXYMETHIONINEA,B,C,D2A9W0.72
CXMN-CARBOXYMETHIONINEX2FTO0.72
CXMN-CARBOXYMETHIONINEA,B1AIQ0.72
CXMN-CARBOXYMETHIONINEA1QQQ0.72
CXMN-CARBOXYMETHIONINEA,B1JTQ0.72
CXMN-CARBOXYMETHIONINEA,B1BQ10.72
CXMN-CARBOXYMETHIONINEA,C1UBP0.72
CXMN-CARBOXYMETHIONINEA3BFI0.72
CXMN-CARBOXYMETHIONINEA,B2G8X0.72
CXMN-CARBOXYMETHIONINEA,B2VF00.72
CXMN-CARBOXYMETHIONINEA,B1ZPR0.72
CXMN-CARBOXYMETHIONINEA3BGX0.72
CXMN-CARBOXYMETHIONINEA1TYS0.72
CXMN-CARBOXYMETHIONINEA2FTQ0.72
CXMN-CARBOXYMETHIONINEA1F4E0.72
CXMN-CARBOXYMETHIONINEA,C1IE70.72
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.73
A14(1S,4S,5S,7R)-7-{[(5S)-5-AMINO-
5-CARBOXYPENTANOYL]AMINO}-3,3-DIMETHYL-
6-OXO-2-THIABICYCLO[3.2.0]HEPTANE-
4-CARBOXYLIC ACID
A2JB40.73
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.74
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.87
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.73
HJ2(2R)-2-[(R)-{[(6S)-6-amino-6-carboxyhexanoyl]amino}(carboxy)methyl]-
5-methyl-3,6-dihydro-2H-1,3-thiazine-
4-carboxylic acid
A3BEC0.7
FMEN-FORMYLMETHIONINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.72
FMEN-FORMYLMETHIONINEA1DZA0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
J,L,M,N,O,P,
S,T,W,Z
2ZXW0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.72
FMEN-FORMYLMETHIONINEC,H,L,M3PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M2PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M1R2C0.72
FMEN-FORMYLMETHIONINEA2W9N0.72
FMEN-FORMYLMETHIONINEA,B,D,E,G,H1KZU0.72
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.72
FMEN-FORMYLMETHIONINEC,H,L,M5PRC0.72
FMEN-FORMYLMETHIONINEA1BQ90.72
FMEN-FORMYLMETHIONINEA2BFR0.72
FMEN-FORMYLMETHIONINEC,D,F1MHC0.72
FMEN-FORMYLMETHIONINEA,B,C1Y4Z0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.72
FMEN-FORMYLMETHIONINEA,B1QX20.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,G1TG60.72
FMEN-FORMYLMETHIONINEA,B,C1Y5N0.72
FMEN-FORMYLMETHIONINEC,H,L,M2I5N0.72
FMEN-FORMYLMETHIONINEA2BFQ0.72
FMEN-FORMYLMETHIONINEA2KAM0.72
FMEN-FORMYLMETHIONINEA,B,C1SIW0.72
FMEN-FORMYLMETHIONINEC,D,I,L1LK60.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.72
FMEN-FORMYLMETHIONINEA1RB90.72
FMEN-FORMYLMETHIONINEC,H,L,M,U1DXR0.72
FMEN-FORMYLMETHIONINEA,B,C,D1DCE0.72
FMEN-FORMYLMETHIONINEC,H,L,M1PRC0.72
FMEN-FORMYLMETHIONINEA,B,C1Y5L0.72
FMEN-FORMYLMETHIONINEA,B,X,Y2G5L0.72
FMEN-FORMYLMETHIONINEA,B,C1Q160.72
FMEN-FORMYLMETHIONINEC,H,L,M2JBL0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F,
G,H
2H610.72
FMEN-FORMYLMETHIONINEC,H,L,M6PRC0.72
FMEN-FORMYLMETHIONINEC,H,L,M3D380.72
FMEN-FORMYLMETHIONINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.72
FMEN-FORMYLMETHIONINEC,D2FMT0.72
FMEN-FORMYLMETHIONINEA1Q7O0.72
FMEN-FORMYLMETHIONINEA,B3D0Y0.72
FMEN-FORMYLMETHIONINEA,B,C,D1V4G0.72
FMEN-FORMYLMETHIONINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.72
FMEN-FORMYLMETHIONINEC,H,L,M7PRC0.72
FMEN-FORMYLMETHIONINEA,B,C,D,E,F1IJD0.72
FMEN-FORMYLMETHIONINEC,H,L,M1VRN0.72
FMEN-FORMYLMETHIONINEA,B,C1Y5I0.72
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.74
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.74
AFJ(2R,4S,5S)-N-butyl-4-hydroxy-2,7-
dimethyl-5-{[N-(4-methylpentanoyl)-
L-methionyl]amino}octanamide
A,B,C3DUY0.74
CYKN-hexanoyl-L-homocysteineA3DHC0.82
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.73
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.74
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.75
C6LN-hexanoyl-L-homoserineA3DHA0.7
C6LN-hexanoyl-L-homoserineA3DHB0.7
LASN-acetyl-S-({(2R,3S,4R)-3-hydroxy-
2-[(1S)-1-hydroxy-2-methylpropyl]-
4-methyl-5-oxopyrrolidin-2-yl}carbonyl)cysteine
A,B3DPM0.73
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.7
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.72
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.77
HFVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-L-3,3,3,3',3',3'-HEXAFLUOROVALINE
A2BU90.72
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,N2Z810.7
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,B,C2Z7X0.7
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.73
GTXS-HEXYLGLUTATHIONEA,B1AGS0.73
GTXS-HEXYLGLUTATHIONEA,B1PN90.73
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.73
GTXS-HEXYLGLUTATHIONEA,B2IMK0.73
GTXS-HEXYLGLUTATHIONEA,B4GSS0.73
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.73
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.73
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.73
GTXS-HEXYLGLUTATHIONEA,B2GLR0.73
GTXS-HEXYLGLUTATHIONEA,B2OA70.73
GTXS-HEXYLGLUTATHIONEA,C2AAW0.73
GTXS-HEXYLGLUTATHIONEA,B1VF20.73
GTXS-HEXYLGLUTATHIONEA1M9A0.73
GTXS-HEXYLGLUTATHIONEA,B17GS0.73
GTXS-HEXYLGLUTATHIONEA,B1K0A0.73
GTXS-HEXYLGLUTATHIONEA,B2R3X0.73
GTXS-HEXYLGLUTATHIONEA,B1GSU0.73
GTXS-HEXYLGLUTATHIONEA,B2C800.73
GTXS-HEXYLGLUTATHIONEA,B2R6K0.73
GTXS-HEXYLGLUTATHIONEA,B1PGT0.73
GTXS-HEXYLGLUTATHIONEA,B2J9H0.73
GTXS-HEXYLGLUTATHIONEA,B1K3L0.73
GTXS-HEXYLGLUTATHIONEA,B1GNW0.73
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.73
GTXS-HEXYLGLUTATHIONEA,B1YDK0.73
GTXS-HEXYLGLUTATHIONEA,B9GSS0.73
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.76
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.76