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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00054942

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,D1RPW0.78
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.8
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.78
B11N-[3-(4-FLUOROPHENOXY)PHENYL]-4-
[(2-HYDROXYBENZYL)AMINO]PIPERIDINE-
1-SULFONAMIDE
A1ZZ20.7
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.72
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.72
LDTIDD594A1US00.73
LDTIDD594A3GHU0.73
LDTIDD594A3GHT0.73
LDTIDD594A2I170.73
LDTIDD594A2QXW0.73
LDTIDD594A3GHS0.73
LDTIDD594A3GHR0.73
LDTIDD594A2PEV0.73
LDTIDD594A2I160.73
LDTIDD594A2PF80.73
LDTIDD594A2PFH0.73
LDTIDD594A2R240.73
BR3(6-METHYL-3,4-DIHYDRO-2H-CHROMEN-
2-YL)METHYLPHOSPHINATE
A1PE50.7
DPDA,B1QIW0.71
DPDA1QIV0.71
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.76
3MB3-METHOXYBENZAMIDEA3PAX0.72
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.7
K55(2S)-2-{4-butoxy-3-[({[2-fluoro-
4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]benzyl}butanoic acid
A,B2ZNP0.71
CMZ(2S)-1-(2,5-dimethylphenoxy)-3-
morpholin-4-ylpropan-2-ol
A2OF00.71
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.7
CTX(Z)-2-[4-(1,2)-DIPHENYL-1-BUTENYL)-
PHENOXY]-N,N-DIMETHYLETHANAMINE
A,B,C1YA40.75
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.71
11N1-[1'-(3-phenylacryloyl)spiro[1-
benzofuran-3,4'-piperidin]-5-yl]methanamine
A,B,C,D2ZEC0.71