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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01090728

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NGPNOGALAMYCIN (PROTONATED FORM)A1L0R0.71
DM5IDARUBICINA,B,D198D0.71
DM5IDARUBICINA1D380.71
DM5IDARUBICINA1D670.71
DRA11-DEOXY-BETA-RHODOMYCINA,B1XDS0.72
TACTETRACYCLINEA,B,C,D,E,F,
G,H,I,J,K,L
2HDN0.95
TACTETRACYCLINEA2VKE0.95
TACTETRACYCLINEA2TRT0.95
TACTETRACYCLINEB2UXO0.95
TACTETRACYCLINEA,B,D,E,G,H,
J,K,L,N,P,Q,
R,T
1I970.95
TACTETRACYCLINEA,D,H,N1HNW0.95
TACTETRACYCLINEA,B2HCJ0.95
AKYA,B,C,D2IPI0.71
ATC9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY-
6-DEMETHYL-TETRACYCLINE
A1ORK0.78
MNGMENOGARILA,B202D0.7
TDC5A,6-ANHYDROTETRACYCLINEA2VKV0.91
TDC5A,6-ANHYDROTETRACYCLINEA2VPR0.91
ERTMETHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY-
7-METHOXY-6,11-DIOXO-4-{[2,3,6-
TRIDEOXY-3-(DIMETHYLAMINO)-BETA-
D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H-
TETRACENE-1-CARBOXYLATE
A,B1TW20.7
ERTMETHYL (4R)-2-ETHYL-2,5,12-TRIHYDROXY-
7-METHOXY-6,11-DIOXO-4-{[2,3,6-
TRIDEOXY-3-(DIMETHYLAMINO)-BETA-
D-RIBO-HEXOPYRANOSYL]OXY}-1H,2H,3H,4H,6H,11H-
TETRACENE-1-CARBOXYLATE
A,B1TW30.7
HEHHEDAMYCINA1JHI0.72
CTC7-CHLOROTETRACYCLINEA1BJ00.88
CTC7-CHLOROTETRACYCLINEA,B1BJY0.88
CTC7-CHLOROTETRACYCLINEA2FJ10.88
CTC7-CHLOROTETRACYCLINEA1DU70.88
CTC7-CHLOROTETRACYCLINEA,B3EGZ0.88
CTC7-CHLOROTETRACYCLINEA2TCT0.88
PY94-{[(2R)-2-(2-methylphenyl)pyrrolidin-
1-yl]carbonyl}benzene-1,3-diol
A,B3EKR0.73
TNC4-DIMETHYLAMINO-1,10,11,12-TETRAHYDROXY-
3-OXO-3,4,4A,5-TETRAHYDRO-NAPHTHACENE-
2-CARBOXYLIC ACID AMIDE
A,B1N5Q0.8
AKA10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)A1Q0Z0.72
NODN-ETHYLHYDROXY-DOXORUBICINA385D0.71
D2C(2S,4S,4AR,5AS,6S,11R,11AS,12R,12AR)-
7-CHLORO-4-(DIMETHYLAMINO)-6,10,11,12-
TETRAHYDROXY-1,3-DIOXO-1,2,3,4,4A,5,5A,6,11,11A,12,12A-
DODECAHYDROTETRACENE-2-CARBOXAMIDE
A,D,M,N,Z2F4V0.77
DXT(4S,4AR,5S,5AR,6R,12AS)-4-(DIMETHYLAMINO)-
3,5,10,12,12A-PENTAHYDROXY-6-METHYL-
1,11-DIOXO-1,4,4A,5,5A,6,11,12A-
OCTAHYDROTETRACENE-2-CARBOXAMIDE
A2O7O0.9
AKT10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)A1Q0R0.72
NGVMETHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-
TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-
1-CARBOXYLATE
A,B,C,D2F980.71
NGVMETHYL 5,7-DIHYDROXY-2-METHYL-4,6,11-
TRIOXO-3,4,6,11-TETRAHYDROTETRACENE-
1-CARBOXYLATE
A1SJW0.71
MIY(4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-
3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-
1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-
2-CARBOXAMIDE
A2DRD0.82
DM41-O-DEMETHYL-6-DEOXYDOXORUBICINA1D370.71
BA1BALANOLA1BX60.72
ECAN,N',N''-[BENZENE-1,3,5-TRIYLTRIS(METHYLENE)]TRIS(2,3-
DIHYDROXYBENZAMIDE)
A,B2CHU0.71