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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03302369

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.7
DESDIETHYLSTILBESTROLA,B3ERD0.7
DESDIETHYLSTILBESTROLA,B1TT60.7
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.7
55E4-(4-hydroxy-3-methylphenyl)-6-
phenylpyrimidin-2(5H)-one
A3DCV0.8
AHT4-(2,5-DIAMINO-5-HYDROXY-PENTYL)-
PHENOL
I,T1TMB0.71
8PP2-[(2E,6E,10E,14E,18E,22E,26E)-
3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-
2,6,10,14,18,22,26,30-OCTAENYL]PHENOL
A,B,C,D1Y0G0.72
EPTHEPTANYL-P-PHENOLA,B1AHZ0.75
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.75
EYK2-tert-butylbenzene-1,4-diolD,F3EYM0.7
EYK2-tert-butylbenzene-1,4-diolB3EYK0.7
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.77
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.72
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.7
2LP2-ALLYLPHENOLA1OV50.73
PCRP-CRESOLA1JHV0.72
PCRP-CRESOLA1JHU0.72
PCRP-CRESOLA,B,C,D1DIQ0.72
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.73
2MP3,4-DIMETHYLPHENOLA1L5O0.71
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.74
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.7
ETY4-ethylphenolA,B,C,D2RA60.73
AEF4-(2-aminoethyl)phenolA3BRA0.72
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.72
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.73