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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00289153

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PN5(3R)-3-hydroxy-2,2-dimethyl-4-oxo-
4-({3-oxo-3-[(2-sulfanylethyl)amino]propyl}amino)butyl 2,2-
dimethylpropanoate
A,B2VU20.78
PM4S-(2-{[N-(2-HYDROXY-4-{[HYDROXY(OXIDO)PHOSPHINO]OXY}-
3,3-DIMETHYLBUTANOYL)-BETA-ALANYL]AMINO}ETHYL) HEXANETHIOATE
A,B2FAC0.7
168PANTOTHENYL-AMINOETHANOL-ACETATE PIVALIC ACIDA,B,C,D1OU60.75
PNS4'-PHOSPHOPANTETHEINEA,B1QJC0.78
PNS4'-PHOSPHOPANTETHEINEA2FVA0.78
PNS4'-PHOSPHOPANTETHEINEA,B,C,D,E,F1VLH0.78
PNS4'-PHOSPHOPANTETHEINEA2KJS0.78
PNS4'-PHOSPHOPANTETHEINEA1OD60.78
PNS4'-PHOSPHOPANTETHEINEA,B3GZM0.78
PNS4'-PHOSPHOPANTETHEINEA2FQ20.78
PNS4'-PHOSPHOPANTETHEINEA2FVF0.78
PNS4'-PHOSPHOPANTETHEINEA,B1H1T0.78
PNS4'-PHOSPHOPANTETHEINEA2K0X0.78
PNS4'-PHOSPHOPANTETHEINEA2FQ00.78
PNS4'-PHOSPHOPANTETHEINEA3GZL0.78
PSRTHIOBUTYRIC ACID S-{2-[3-(2-HYDROXY-
3,3-DIMETHYL-4-PHOSPHONOOXY-BUTYRYLAMINO)-
PROPIONYLAMINO]-ETHYL} ESTER
A1L0I0.74
PSRTHIOBUTYRIC ACID S-{2-[3-(2-HYDROXY-
3,3-DIMETHYL-4-PHOSPHONOOXY-BUTYRYLAMINO)-
PROPIONYLAMINO]-ETHYL} ESTER
A2KG90.74
OPIPANTOTHENYL-AMINOETHANOL-11-PIVALIC ACIDA,B,C,D2VU10.77
PAUPANTOTHENOIC ACIDA,B2F9W0.79
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BF10.79
PAUPANTOTHENOIC ACIDA,B,C,D1SQ50.79
PAUPANTOTHENOIC ACIDA,B,C,D,E,F3BEX0.79
PN2A,D,E,F1F800.72
SXVN~3~-[(2S)-2-hydroxy-3,3-dimethyl-
4-(phosphonooxy)butanoyl]-N-{2-
[(3-oxobutyl)sulfanyl]ethyl}-beta-
alaninamide
A2KGD0.73
PCO2,4-DIHYDROXY-N-[2-(2-MERCAPTO-
VINYLCARBAMOYL)-ETHYL]-3,3-DIMETHYL-
BUTYRAMIDE
A1MVN0.78
PAZN-[(2R)-2-hydroxy-3,3-dimethyl-
4-(phosphonooxy)butanoyl]-beta-
alanine
A,B,C,D,E,F3BF30.72
SXATHIOACETIC ACID S-{2-[3-(2-HYDROXY-
3,3-DIMETHYL-4-PHOSPHONOOXY-BUTYRYLAMINO)-
PROPIONYLAMINO]-ETHYL} ESTER
A2KG60.75