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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03427870

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER		D,E,F,G,H1MD20.78
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.85
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.85
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.85
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.85
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.85
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.85
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.85
AMN9-DEOXY-9-AMINO-2-O-METHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGJ1
7GPETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3S0.77
AXP4-ACETAMIDO-2,4-DIDEXOY-D-GLYCERO-
BETA-D-GALACTO-OCTOPYRANOSYLPHOSPHONIC ACID (AN AXIAL PHOSPHONATE)		A1INW0.75
AXP4-ACETAMIDO-2,4-DIDEXOY-D-GLYCERO-
BETA-D-GALACTO-OCTOPYRANOSYLPHOSPHONIC ACID (AN AXIAL PHOSPHONATE)		A1DIL0.75
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		B2F4U0.79
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A2JCQ0.73
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B2IH90.73
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B,C,D,E,F2J2P0.73
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A3DIV0.73
ANA4-O-ACETYL-ALPHA-2-OMETHYL-5-N-
ACETYL-ALPHA-D-NEURAMINIC ACID		A,B,C,D,E,F1HGI0.99
6GPMETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3Q0.76
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.73
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWG0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HM20.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWF0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OFL0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A3C9E0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A2C4S0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1C4S0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OFM0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1OJO0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HMW0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1DQO0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1HMU0.74
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE		A1RWH0.74
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,B2G5Q0.77
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,D1I1D0.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2DKC0.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,C,D,E,F1NE70.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FS50.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2O280.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FRZ0.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1HOT0.74
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA2VXK0.74
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A1ZT40.82
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A,C,E2PO60.82
ABW5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID		A1XOG0.77
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M		3EFX0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.76
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W		2O2L0.76
AH02-(2-ACETYLAMINO-4-HYDROXY-6,8-
DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-
PROPIONIC ACID		A1QTE0.82
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol		A,B2VLC0.79
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,Z2F4V0.77
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		B2F4T0.77
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.87
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.87