MMsINC Database Search
logo   logo
logo Search | Help | MolPaint | Roadmap | Credits | Feedback


Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02456994

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
EB4N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-
1,5,9-trioxacyclododecane-3,7,11-
triyl]tris(2,3-dihydroxybenzamide)		A,B,C3CMP0.7
NGMNOGALAMYCINA,B,C,D258D0.76
NGMNOGALAMYCINA282D0.76
NGMNOGALAMYCINA,B224D0.76
NGMNOGALAMYCINA,B245D0.76
NGMNOGALAMYCINA,B1QCH0.76
NGMNOGALAMYCINA1D170.76
NGMNOGALAMYCINA,B1D210.76
NGMNOGALAMYCINA,B182D0.76
DDIA1R4E0.72
DDIA1P960.72
AKYA,B,C,D2IPI0.79
S2AA2OEY0.74
ZCTA,B,C,D,E,F,
G,H		3B6A0.74
PH52-PHENYL-PROP5ACA,B2BVE0.71
HEHHEDAMYCINA1JHI0.73
NGPNOGALAMYCIN (PROTONATED FORM)A1L0R0.79
485[2-AMINO-3-(4-HYDROXY-PHENYL)-PROPIONYLAMINO]-
(3,4,5-TRIHYDROXY-6-METHYL-TETRAHYDRO-
PYRAN-2-YL)- ACETIC ACID		A1JIL0.72
TACTETRACYCLINEA,B,C,D,E,F,
G,H,I,J,K,L		2HDN0.74
TACTETRACYCLINEA2VKE0.74
TACTETRACYCLINEA2TRT0.74
TACTETRACYCLINEB2UXO0.74
TACTETRACYCLINEA,B,D,E,G,H,
J,K,L,N,P,Q,
R,T		1I970.74
TACTETRACYCLINEA,D,H,N1HNW0.74
TACTETRACYCLINEA,B2HCJ0.74
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		A2O7O0.77
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE		A,B,C,D2F990.73
AKA10-DECARBOXYMETHYLACLACINOMYCIN A (DCMAA)A1Q0Z0.8
SDN[(3S)-9-hydroxy-1-methyl-10-oxo-
4,10-dihydro-3H-benzo[g]isochromen-
3-yl]acetic acid		A,B3B6C0.71
MUS4-METHYL-2-OXO-2H-CHROMEN-7-YL 5-
(ACETYLAMINO)-3,5-DIDEOXY-L-ERYTHRO-
NON-2-ULOPYRANOSIDONIC ACID		A1S0J0.72
AKT10-DECARBOXYMETHYLACLACINOMYCIN T (DCMAT)A1Q0R0.82
BNRBIS-DAUNORUBICINB1AMD0.76
DM41-O-DEMETHYL-6-DEOXYDOXORUBICINA1D370.86
DM82'-BROMO-4'-EPIDAUNORUBICINA276D0.82
DM82'-BROMO-4'-EPIDAUNORUBICINA288D0.82
DM82'-BROMO-4'-EPIDAUNORUBICINA277D0.82
DM82'-BROMO-4'-EPIDAUNORUBICINA,B380D0.82
DM82'-BROMO-4'-EPIDAUNORUBICINA,B381D0.82
DM82'-BROMO-4'-EPIDAUNORUBICINA278D0.82
AI1N-BENZYL-3-(ALPHA-D-GALACTOS-1-
YL)-BENZAMIDE		D,E,F,G,H,L,
M,N,O,P		1FD70.72
44D7-[5-(4-AMINO-5-HYDROXY-6-METHYL-
TETRAHYDRO-PYRAN-2-YLOXY)-4-HYDROXY-
6-METHYL-TETRAHYDRO-PYRAN-2-YLOXY]-
6,9,11-TRIHYDROXY-9-(2-HYDROXY-
ACETYL)-7,8,9,10-TETRAHYDRO-NAPHTHACENE-
5,12-DIONE		A,B1NAB0.85
NOM7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO-
1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE-
2,6,11-TRIONE		A1N5V0.77
RUTRUTINA,B1RY80.7
DM1DAUNOMYCINA152D0.85
DM1DAUNOMYCINA,B,C,D1O0K0.85
DM1DAUNOMYCINA1JO20.85
DM1DAUNOMYCINA,B308D0.85
DM1DAUNOMYCINA1D330.85
DM1DAUNOMYCINA110D0.85
DM1DAUNOMYCINA1D110.85
DM1DAUNOMYCINA427D0.85
DM1DAUNOMYCINA2D340.85
DM1DAUNOMYCINA3F8F0.85
DM1DAUNOMYCINA1D100.85
DM1DAUNOMYCINA1DA00.85
NGUU-58872, HYDROXY DERIVATIVE OF NOGALAMYCINA,B1D220.76
MNGMENOGARILA,B202D0.79
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID		A,B1KR30.71
1137,8-DIHYDROXY-1-METHOXY-3-METHYL-
10-OXO-4,10-DIHYDRO-1H,3H-PYRANO[4,3-
B]CHROMENE-9-CARBOXYLIC ACID		A,B1HLK0.71
BA1BALANOLA1BX60.73
BAD(1S)-2-amino-1-phenylethyl 6-O-
beta-L-glucopyranosyl-alpha-D-mannopyranoside		A2QJE0.7
DM36-DEOXYDAUNOMYCINA1D140.84
DM74'-DEOXY-4'-IODODOXORUBICINA1IMR0.81
DM74'-DEOXY-4'-IODODOXORUBICINA1IMS0.81
DM5IDARUBICINA,B,D198D0.86
DM5IDARUBICINA1D380.86
DM5IDARUBICINA1D670.86
CMD3'-DESAMINO-3'-(3-CYANO-4-MORPHOLINYL)-
DOXORUBICIN		A236D0.77
DM9N-HYDROXYMETHYL-N-(2-METHOXYETHYL)-
DAUNOMYCIN		A482D0.73
HMY(1aR,8S,13S,14S,15aR)-5,13,14-trihydroxy-
3-methoxy-8-methyl-8,9,13,14,15,15a-
hexahydro-6H-oxireno[k][2]benzoxacyclotetradecine-
6,12(1aH)-dione		A,B3C9W0.71
OBE3-(3-HYDROXY-BENZOYLOXY)-8-METHYL-
8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID		H1RIV0.74
DM64'-EPIDOXORUBICINA1D150.85
DM64'-EPIDOXORUBICINA1D540.85
DM64'-EPIDOXORUBICINA1D580.85
DM64'-EPIDOXORUBICINA1QDA0.85
DM2DOXORUBICINA2DR60.85
DM2DOXORUBICINA1P200.85
DM2DOXORUBICINA1I1E0.85
DM2DOXORUBICINA151D0.85
DM2DOXORUBICINA1D120.85
DM2DOXORUBICINA1DA90.85
MAR4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCINA1D360.84
MAR4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCINA1R680.84
MAR4'-EPI-4'-(2-DEOXYFUCOSE)DAUNOMYCINA1D350.84
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
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AL90.77
BDA4-METHYLBENZYL-N-BIS[DAUNOMYCIN]A1AGL0.77
7CA5,7-DIHYDROXY-2-(4-METHOXYPHENYL)-
8-(3-METHYLBUTYL)-4-OXO-4H-CHROMEN-
3-YL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE		A2H440.71
SHP(4-HYDROXYMALTOSEPHENYL)GLYCINEA1DSR0.75
DRA11-DEOXY-BETA-RHODOMYCINA,B1XDS0.8
CHRNEOCARZINOSTATIN-CHROMOPHOREA1O5P0.76
CHRNEOCARZINOSTATIN-CHROMOPHOREA,B1NCO0.76
GUM4-METHYL-UMBELLIFERYL-N-ACETYL-
CHITOBIOSE		A1BB70.7
DMM3'-DESAMINO-3'-(2-METHOXY-4-MORPHOLINYL)-
DOXORUBICIN		A215D0.79
DMM3'-DESAMINO-3'-(2-METHOXY-4-MORPHOLINYL)-
DOXORUBICIN		A235D0.79
DMM3'-DESAMINO-3'-(2-METHOXY-4-MORPHOLINYL)-
DOXORUBICIN		A234D0.79
DMM3'-DESAMINO-3'-(2-METHOXY-4-MORPHOLINYL)-
DOXORUBICIN		A,B2DES0.79
DZNDAIDZINA,B,C,D,E,F,
G,H		2VLE0.74
NCSB1KVH0.75
NCSA2NEO0.75
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,B1TW20.79
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,B1TW30.79
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE		A,B1D830.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE		A,B1EKH0.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE		A,B1EKI0.73
CPH1,8-DIHYDROXY-7-METHYL-3-(1,3,4-
TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO-
2H-ANTHRACEN-9-ONE		A,B,C,D1VAQ0.73
NODN-ETHYLHYDROXY-DOXORUBICINA385D0.82