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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00016266

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AKN(2R)-4-AMINO-N-{(1R,2S,3S,4R,5S)-
5-AMINO-2-[(3-AMINO-3-DEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-4-[(6-AMINO-
6-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]-
3-HYDROXYCYCLOHEXYL}-2-HYDROXYBUTANAMIDE		A,B2G5Q0.75
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.85
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.85
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWG0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HM20.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWF0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OFL0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A3C9E0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A2C4S0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1C4S0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OFM0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OJO0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HMW0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1DQO0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HMU0.77
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWH0.77
AMN9-DEOXY-9-AMINO-2-O-METHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGJ0.97
AXP4-ACETAMIDO-2,4-DIDEXOY-D-GLYCERO-
BETA-D-GALACTO-OCTOPYRANOSYLPHOSPHONIC ACID (AN AXIAL PHOSPHONATE)		A1INW0.77
AXP4-ACETAMIDO-2,4-DIDEXOY-D-GLYCERO-
BETA-D-GALACTO-OCTOPYRANOSYLPHOSPHONIC ACID (AN AXIAL PHOSPHONATE)		A1DIL0.77
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A2JCQ0.75
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B2IH90.75
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B,C,D,E,F2J2P0.75
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A3DIV0.75
AB6(2R)-4-AMINO-N-((1R,2S,3R,4R,5S)-
5-AMINO-4-[(2-AMINO-2-DEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-2-{2-[(3-
AMINOPROPYL)AMINO]ETHOXY}-3-HYDROXYCYCLOHEXYL)-
2-HYDROXYBUTANAMIDE		B2F4U0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,D1I1D0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2DKC0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,C,D,E,F1NE70.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FS50.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2O280.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FRZ0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1HOT0.76
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA2VXK0.76
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.75
ABW5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID		A1XOG0.78
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER		D,E,F,G,H1MD20.79
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		A,D,M,N,Z2F4V0.75
AB9(2R)-4-AMINO-N-{(1R,2S,3R,4R,5S)-
5-AMINO-2-{2-[(2-AMINOETHYL)AMINO]ETHOXY}-
4-[(2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSYL)OXY]-3-HYDROXYCYCLOHEXYL}-
2-HYDROXYBUTANAMIDE		B2F4T0.75
ANA4-O-ACETYL-ALPHA-2-OMETHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGI0.98
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M		3EFX0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.79
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W		2O2L0.79
7GPETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3S0.79
AH02-(2-ACETYLAMINO-4-HYDROXY-6,8-
DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-
PROPIONIC ACID		A1QTE0.81
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.87
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.87
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.87
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.87
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.87
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.87
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.87
6GPMETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3Q0.78
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A1ZT40.81
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A,C,E2PO60.81
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol		A,B2VLC0.76