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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00750324

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.86
FIL(1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O-
(AMINOCARBONYL)OXIME
A,B1XLZ0.72
TL32,5-BIS-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5B0.78
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.72
MR11-(1,3-BENZODIOXOL-5-YL)METHANAMINEA2ORQ0.72
PET1,5-DI(4-AMIDINOPHENOXY)-3-OXA-
PENTANE
B166D0.84
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEB102D0.85
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEA1PRP0.85
TL42-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
5-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5U0.76
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.73
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.78
TL12,5-BIS-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y590.75
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR40.84
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEB1D640.84
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR50.84
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEA,B,D,E1RKW0.84
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.7
TL22-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
5-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5A0.76
BGF2,5-BIS(4-GUANYLPHENYL)FURANA227D0.71