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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02487089

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AH02-(2-ACETYLAMINO-4-HYDROXY-6,8-
DIOXA-BICYCLO[3.2.1]OCT-3-YLOXY)-
PROPIONIC ACID
A1QTE0.73
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,B2G5Q0.73
AMUBETA-N-ACETYLMURAMIC ACIDA,B,C,D2APH0.75
AMUBETA-N-ACETYLMURAMIC ACIDA,P1TWQ0.75
AMUBETA-N-ACETYLMURAMIC ACIDA1D0K0.75
AMUBETA-N-ACETYLMURAMIC ACIDS9LYZ0.75
AMUBETA-N-ACETYLMURAMIC ACIDE,S148L0.75
AMUBETA-N-ACETYLMURAMIC ACIDD,K3CYQ0.75
AMUBETA-N-ACETYLMURAMIC ACIDU2AIZ0.75
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWG0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HM20.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWF0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OFL0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A3C9E0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A2C4S0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1C4S0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OFM0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1OJO0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HMW0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1DQO0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1HMU0.72
ASG2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-
4-SULFATE
A1RWH0.72
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8G0.77
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE
A2J8F0.77
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE
A1ZJ20.72
DR36-DEOXY-ALPHA-L-GLUCOPYRANOSYL-
(1->2)-BETA-D-GULOPYRANOSYL-(1-
>3)-2-DEOXY-2-[(1-HYDROXYETHYL)AMINO]-
ALPHA-L-TALOPYRANOSE
A1ZI50.72
CTOTRIACETYLCHITOTRIOSEA,B1BB50.77
CTOTRIACETYLCHITOTRIOSEB2H5Z0.77
CTOTRIACETYLCHITOTRIOSEA,B,C,D2R0H0.77
CTOTRIACETYLCHITOTRIOSEA,B,C2AH90.77
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A2QKX0.71
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A,B2YQH0.71
GN12-(ACETYLAMINO)-2-DEOXY-1-O-PHOSPHONO-
ALPHA-D-GLUCOPYRANOSE
A,B2OI70.71
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M
3EFX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W
2O2L0.74
FSMFORSMANN ANTIGENA2CGY0.78
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol
A,B2VLC0.78
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,D1I1D0.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2DKC0.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B,C,D,E,F1NE70.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FS50.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B2O280.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1FRZ0.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA,B1HOT0.71
16GN-ACETYL-D-GLUCOSAMINE-6-PHOSPHATEA2VXK0.71
CNY13,15-DIAMINO-2-(AMINOMETHYL)-3,4,9,12-
TETRAHYDROXYHEXADECAHYDRO-2H-7,10-
EPOXYPYRANO[2,3-B][1,10,4]BENZODIOXAZACYCLODODECIN-
8-YL 2,6-DIAMINO-2,6-DIDEOXYHEXOPYRANOSIDE
A,C,D1ZZ50.71
BGNN-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDEA,B,C,D1NWG0.73
EAG2-aminoethyl 2-(acetylamino)-2-
deoxy-beta-D-glucopyranoside
B,D,E,F,H3BZ40.78
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE
A3E6J0.77
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE
A1ZJ30.77
DR26-DEOXY-ALPHA-L-IDOPYRANOSYL-(1-
>2)-ALPHA-D-GLUCOPYRANOSYL-(1->4)-
2-(ACETYLAMINO)-2-DEOXY-BETA-L-
GULOPYRANOSE
A1ZI40.77
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
B2F4U0.75
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1LJN0.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1ZU00.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A2HRH0.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B1TW50.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,H2HRG0.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)12BS70.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7T0.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A,B2QT60.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1QBB0.78
CBSDI(N-ACETYL-D-GLUCOSAMINE)A1C7S0.78
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
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE
A,B,C,D,E,F2J0G0.74
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE
A,B,C2ORJ0.74