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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03693304

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.72
IBN2-METHYLPROPAN-1-AMINEA,B2QDY0.86
LEN3-METHYLBUTAN-1-AMINEA1PE50.86
LEN3-METHYLBUTAN-1-AMINEA1PE70.86
LEN3-METHYLBUTAN-1-AMINEA1PE80.86
DCI2-METHYL-BUTYLAMINEE,I1ENT0.86
DCI2-METHYL-BUTYLAMINEA,I1GVW0.86
DCI2-METHYL-BUTYLAMINEE1EPP0.86
DCI2-METHYL-BUTYLAMINEI4ER10.86
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.72
NEHETHANAMINEA1YY20.79
NEHETHANAMINEA,B2IBI0.79
B2IISOLEUCINE BORONIC ACIDA,P1P040.76
B2IISOLEUCINE BORONIC ACIDE,I5EST0.76
13D1,3-DIAMINOPROPANEA,B2F8W0.76
1CBCYCLOPENTANAMINEA2AS60.72
N2PPENTANE-1,5-DIAMINEA,B2OO00.82
N2PPENTANE-1,5-DIAMINEA,B1H3M0.82
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.82
NPTNEOPENTYLAMINEI1IVQ0.81
B2VVALINE BORONIC ACIDA,P2LPR0.75
B2VVALINE BORONIC ACIDA,P1P030.75
B2VVALINE BORONIC ACIDA,P1P100.75
B2VVALINE BORONIC ACIDA,B2H5D0.75
B2VVALINE BORONIC ACIDA,P1P010.75
BNONORLEUCINE BORONIC ACIDA,P6LPR0.79
BNONORLEUCINE BORONIC ACIDA,P3LPR0.79
BNONORLEUCINE BORONIC ACIDA,P1P050.79
B2AALANINE BORONIC ACIDA2PWA0.73
B2AALANINE BORONIC ACIDA,P1GBF0.73
B2AALANINE BORONIC ACIDA,P1P020.73
B2AALANINE BORONIC ACIDA,P1GBB0.73
B2AALANINE BORONIC ACIDA,P1GBK0.73
B2AALANINE BORONIC ACIDA,P5LPR0.73
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.75
BPTBIS(TRANS-PLATINUM ETHYLENEDIAMINE DIAMINE CHLORO)COMPLEXA1AU60.75
LYTBUTYLAMINEA1EAG1
NBNN-BUTYL ISOCYANIDEA108M0.71
NBNN-BUTYL ISOCYANIDEA,B1NBB0.71
NBNN-BUTYL ISOCYANIDEA103M0.71
NBNN-BUTYL ISOCYANIDEA,B2HBE0.71
NBNN-BUTYL ISOCYANIDEA1GEJ0.71
NBNN-BUTYL ISOCYANIDEA111M0.71
NBNN-BUTYL ISOCYANIDEA1GEK0.71
NBNN-BUTYL ISOCYANIDEA101M0.71
NBNN-BUTYL ISOCYANIDEA104M0.71
NBNN-BUTYL ISOCYANIDEA2MYC0.71
NBNN-BUTYL ISOCYANIDEA1GEI0.71
NBNN-BUTYL ISOCYANIDEA1GEM0.71
NBNN-BUTYL ISOCYANIDEA105M0.71
NBNN-BUTYL ISOCYANIDEA107M0.71
NBNN-BUTYL ISOCYANIDEA,B1S610.71
ETNMETHYLETHYLAMINEA1TES0.73
AMLAMYLAMINEA1JIR0.9
PUT1,4-DIAMINOBUTANEA1I7B0.9
PUT1,4-DIAMINOBUTANEA,B3DZ60.9
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.9
PUT1,4-DIAMINOBUTANEA1I790.9
PUT1,4-DIAMINOBUTANEA,B2O060.9
PUT1,4-DIAMINOBUTANEA,B1JL00.9
PUT1,4-DIAMINOBUTANEA1I720.9
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.9
PUT1,4-DIAMINOBUTANEA,B3DZ40.9
PUT1,4-DIAMINOBUTANEA,B3H0W0.9
PUT1,4-DIAMINOBUTANEA,B3DZ30.9
PUT1,4-DIAMINOBUTANEA,B1MSV0.9
PUT1,4-DIAMINOBUTANEA1I7C0.9
PUT1,4-DIAMINOBUTANEA,B3DZ70.9
PUT1,4-DIAMINOBUTANEA,B3EPB0.9
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.9
PUT1,4-DIAMINOBUTANEA,B3DZ20.9
PUT1,4-DIAMINOBUTANEA,B3DZ50.9
PUT1,4-DIAMINOBUTANEA,B3EPA0.9
PUT1,4-DIAMINOBUTANEA,B3H0V0.9
BLELEUCINE BORONIC ACIDA,P1GBL0.76
BLELEUCINE BORONIC ACIDA,P9LPR0.76
BLELEUCINE BORONIC ACIDA,P7LPR0.76
BLELEUCINE BORONIC ACIDA,P1GBC0.76
BLELEUCINE BORONIC ACIDA,P1GBH0.76
3CN3-AMINOPROPANEA,B,C,D3C0R0.89
3CN3-AMINOPROPANEB3BY40.89
16DHEXANE-1,6-DIAMINEA,B,C2QK90.75
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.75
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.7
N3DN-methylpropane-1,3-diamineA,B3EY20.72