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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00054916

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.71
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.78
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.71
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.74
11N1-[1'-(3-phenylacryloyl)spiro[1-
benzofuran-3,4'-piperidin]-5-yl]methanamine
A,B,C,D2ZEC0.73
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.73
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.74
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
BGF2,5-BIS(4-GUANYLPHENYL)FURANA227D0.7
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.84
COUCOUMARINA3CRB0.71
COUCOUMARINA2PMJ0.71
COUCOUMARINA2H900.71
COUCOUMARINA,B,C,D1Z100.71
COUCOUMARINA2PWB0.71
AL9N-[(4-METHOXYPHENYL)METHYL]2,5-
THIOPHENEDESULFONAMIDE
A1BN40.73
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.74
CTX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINE
A,B,C1YA40.77
DPDA,B1QIW0.73
DPDA1QIV0.73
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.74
AEF4-(2-aminoethyl)phenolA3BRA0.77
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.74
3MB3-METHOXYBENZAMIDEA3PAX0.73
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.76