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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03786281

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
P124-[AMINO(IMINO)METHYL]-1-[2-(3-
AMMONIOPROPOXY)-5-METHOXYBENZYL]PIPERAZIN-
1-IUM
B1UUI0.81
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEB102D0.8
TNT1,3-BIS(AMIDINOPHENOXY)PROPANEA1PRP0.8
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.79
P14N-[2-(2-{[(4-{[AMINO(IMINO)METHYL]AMINO}BUTYL)AMINO]METHYL}-
4-METHOXYPHENOXY)ETHYL]GUANIDINE
B1UUD0.79
PET1,5-DI(4-AMIDINOPHENOXY)-3-OXA-
PENTANE
B166D0.78
TL12,5-BIS-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y590.78
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR40.78
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEB1D640.78
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEX3CR50.78
PNT1,5-BIS(4-AMIDINOPHENOXY)PENTANEA,B,D,E1RKW0.78
TL22-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
5-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5A0.77
TL42-O-{3-[AMINO(IMINO)METHYL]PHENYL}-
5-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5U0.77
TL32,5-BIS-O-{4-[AMINO(IMINO)METHYL]PHENYL}-
1,4:3,6-DIANHYDRO-D-GLUCITOL
T1Y5B0.75
IMY1-{[4,5-BIS(4-CHLOROPHENYL)-2-(2-
ISOPROPOXY-4-METHOXYPHENYL)-4,5-
DIHYDRO-1H-IMIDAZOL-1-YL]CARBONYL}PIPERAZINE
A1TTV0.73
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.72
DPDA,B1QIW0.72
DPDA1QIV0.72
332(3R)-3-[(1,2,3,4-tetrahydroisoquinolin-
7-yloxy)methyl]-2,3-dihydrothieno[2,3-
f][1,4]oxazepin-5-amine
A,B3EBF0.71
GP81-(2-AMIDINOPHENYL)-3-(PHENOXYPHENYL)UREAA1BJV0.71
BPF2,5-BIS{[4-(N-ETHYLAMIDINO)]PHENYL}FURANA,B360D0.71
RFX(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWV0.71
SFX(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWW0.71
SAG(S)-(+)-2-[4-(FLUOROBENZYLOXY-BENZYLAMINO)PROPIONAMIDE]A,B2V5Z0.7
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.7