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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02901066

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.72
2MHcis-4-methylcyclohexanamineA,B,C2PT90.74
AMLAMYLAMINEA1JIR0.78
DIAOCTANE 1,8-DIAMINEA,B3BI50.71
DIAOCTANE 1,8-DIAMINEA,B,C1H830.71
16DHEXANE-1,6-DIAMINEA,B,C2QK90.79
16DHEXANE-1,6-DIAMINEA,B,C,D,E,F1WOG0.79
BLELEUCINE BORONIC ACIDA,P1GBL0.73
BLELEUCINE BORONIC ACIDA,P9LPR0.73
BLELEUCINE BORONIC ACIDA,P7LPR0.73
BLELEUCINE BORONIC ACIDA,P1GBC0.73
BLELEUCINE BORONIC ACIDA,P1GBH0.73
PUT1,4-DIAMINOBUTANEA1I7B0.7
PUT1,4-DIAMINOBUTANEA,B3DZ60.7
PUT1,4-DIAMINOBUTANEA,B,C,D1I7M0.7
PUT1,4-DIAMINOBUTANEA1I790.7
PUT1,4-DIAMINOBUTANEA,B2O060.7
PUT1,4-DIAMINOBUTANEA,B1JL00.7
PUT1,4-DIAMINOBUTANEA1I720.7
PUT1,4-DIAMINOBUTANEA,B,C,D1A990.7
PUT1,4-DIAMINOBUTANEA,B3DZ40.7
PUT1,4-DIAMINOBUTANEA,B3H0W0.7
PUT1,4-DIAMINOBUTANEA,B3DZ30.7
PUT1,4-DIAMINOBUTANEA,B1MSV0.7
PUT1,4-DIAMINOBUTANEA1I7C0.7
PUT1,4-DIAMINOBUTANEA,B3DZ70.7
PUT1,4-DIAMINOBUTANEA,B3EPB0.7
PUT1,4-DIAMINOBUTANEA,B,C,D1F3T0.7
PUT1,4-DIAMINOBUTANEA,B3DZ20.7
PUT1,4-DIAMINOBUTANEA,B3DZ50.7
PUT1,4-DIAMINOBUTANEA,B3EPA0.7
PUT1,4-DIAMINOBUTANEA,B3H0V0.7
297dodecane-1,12-diamineA,B3BI20.71
IBN2-METHYLPROPAN-1-AMINEA,B2QDY0.74
LEN3-METHYLBUTAN-1-AMINEA1PE50.81
LEN3-METHYLBUTAN-1-AMINEA1PE70.81
LEN3-METHYLBUTAN-1-AMINEA1PE80.81
A72TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.74
A71(6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEXA,B2DYW0.76
BLYLYSINE BORONIC ACIDA,H1BTZ0.73
BLYLYSINE BORONIC ACIDA,H1BTW0.73
LYTBUTYLAMINEA1EAG0.7
AMCAMINOMETHYLCYCLOHEXANEA1TNG0.78
AMCAMINOMETHYLCYCLOHEXANEA,B1DLG0.78
DCI2-METHYL-BUTYLAMINEE,I1ENT0.81
DCI2-METHYL-BUTYLAMINEA,I1GVW0.81
DCI2-METHYL-BUTYLAMINEE1EPP0.81
DCI2-METHYL-BUTYLAMINEI4ER10.81
N2PPENTANE-1,5-DIAMINEA,B2OO00.78
N2PPENTANE-1,5-DIAMINEA,B1H3M0.78
N2PPENTANE-1,5-DIAMINEA,B,C,D1GZL0.78
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.76
B2IISOLEUCINE BORONIC ACIDA,P1P040.73
B2IISOLEUCINE BORONIC ACIDE,I5EST0.73
BNONORLEUCINE BORONIC ACIDA,P6LPR0.7
BNONORLEUCINE BORONIC ACIDA,P3LPR0.7
BNONORLEUCINE BORONIC ACIDA,P1P050.7