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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02883239

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NLX(5A,17R)-4,5-EPOXY-3,14-DIHYDROXY-
17-METHYL-6-OXO-17-(2-PROPENYL)-
MORPHINANIUM		A,B,C,D,E,F,
G,H,I,J,K,L		1MX90.73
MOI(7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A-
HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2-
E]ISOQUINOLINE-7,9-DIOL		H,L1Q0Y0.74
HMK(6AR,12AR)-6H-[1,3]DIOXOLO[5,6][1]BENZOFURO[3,2-
C]CHROMENE-3,6A(12AH)-DIOL		A1ZGA0.74
5RM(5R)-5-(4-methoxy-3-propoxyphenyl)-
5-methyl-1,3-oxazolidin-2-one		A,B1XM60.7
P1S(6AR,12AR)-3-(HYDROXYMETHYL)-6H-
[1,3]DIOXOLO[5,6][1]BENZOFURO[3,2-
C]CHROMEN-6A(12AH)-OL		A1ZGJ0.75
ANMANISOMYCIN1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z		1K730.71
ANMANISOMYCIN0,1,3,9,A,B,
C,F,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3CC40.71
GNT(-)-GALANTHAMINEA1DX60.78
GNT(-)-GALANTHAMINEA1QTI0.78
GNT(-)-GALANTHAMINEA,B,C,D,E2PH90.78
GNT(-)-GALANTHAMINEA,B1W760.78
GNT(-)-GALANTHAMINEA1W6R0.78
CM4(2R,3R,4S)-3-(4-HYDROXYPHENYL)-
4-METHYL-2-[4-(2-PYRROLIDIN-1-YLETHOXY)PHENYL]CHROMAN-
6-OL		A1YIM0.72
AB8(1S,3R,8AS)-8-(2-{(4S,6S)-3-(4-
HYDROXY-3-METHOXYBENZYL)-4-[2-(METHYLAMINO)-
2-OXOETHYL]-2-OXO-1,3-OXAZINAN-
6-YL}ETHYL)-3,7-DIMETHYL-1,2,3,7,8,8A-
HEXAHYDRONAPHTHALEN-1-YL (2R)-2-
METHYLBUTANOATE		A,B1XDG0.7
MUS4-METHYL-2-OXO-2H-CHROMEN-7-YL 5-
(ACETYLAMINO)-3,5-DIDEOXY-L-ERYTHRO-
NON-2-ULOPYRANOSIDONIC ACID		A1S0J0.72
CHRNEOCARZINOSTATIN-CHROMOPHOREA1O5P0.72
CHRNEOCARZINOSTATIN-CHROMOPHOREA,B1NCO0.72
DM9N-HYDROXYMETHYL-N-(2-METHOXYETHYL)-
DAUNOMYCIN		A482D0.71
GUM4-METHYL-UMBELLIFERYL-N-ACETYL-
CHITOBIOSE		A1BB70.75
NCSB1KVH0.7
NCSA2NEO0.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B2QCI0.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B2QD60.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B2QD80.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B2Z4O0.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B2QD70.7
065(3R,3AS,6AR)-HEXAHYDROFURO[2,3-
B]FURAN-3-YL(2S,3R)-3-HYDROXY-4-
(N-ISOBUTYLBENZO[D][1,3]DIOXOLE-
5-SULFONAMIDO)-1-PHENYLBUTAN-2-
YLCARBAMATE		A,B3ECG0.7
DPDA,B1QIW0.73
DPDA1QIV0.73
AI1N-BENZYL-3-(ALPHA-D-GALACTOS-1-
YL)-BENZAMIDE		D,E,F,G,H,L,
M,N,O,P		1FD70.7
EH5N-(1-BENZYL-3-{[3-(1,3-DIOXO-1,3-
DIHYDRO-ISOINDOL-2-YL)-PROPIONYL]-
[2-(HEXAHYDRO-BENZO[1,3]DIOXOL-
5-YL)-ETHYL]-AMINO}-2-HYDROXY-PROPYL)-
4-BENZYLOXY-3,5-DIMETHOXY-BENZAMIDE		A1LF30.74
AHF2-[4-(HYDROXY-METHOXY-METHYL)-BENZYL]-
7-(4-HYDROXYMETHYL-BENZYL)-1,1-
DIOXO-3,6-BIS-PHENOXYMETHYL-1LAMBDA6-
[1,2,7]THIADIAZEPANE-4,5-DIOL		B1G350.7
HMT(3beta)-O~3~-[(2R)-2,6-dihydroxy-
2-(2-methoxy-2-oxoethyl)-6-methylheptanoyl]cephalotaxine		0,1,2,3,9,A,
B,C,F,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		3G6E0.72