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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010258

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.77
SPDSPERMIDINE1,2,3,41POY0.72
SPDSPERMIDINEA,B3BXZ0.72
SPDSPERMIDINEA2ELG0.72
SPDSPERMIDINEA,B,C2PWP0.72
SPDSPERMIDINEA,B1BO40.72
SPDSPERMIDINEA,B,C,D3C6K0.72
SPDSPERMIDINEA,B2O070.72
SPDSPERMIDINEA2P1E0.72
SPDSPERMIDINEA,B293D0.72
SPDSPERMIDINEA,B1TYP0.72
SPDSPERMIDINEA,B,C,D2QBY0.72
SPDSPERMIDINEA,B3CN80.72
SPDSPERMIDINEA1U8D0.72
SPDSPERMIDINEA2P180.72
SPDSPERMIDINEA,B2HMP0.72
SPDSPERMIDINED1I2X0.72
SPDSPERMIDINEA1POT0.72
B33N-ETHYL-N-[3-(PROPYLAMINO)PROPYL]PROPANE-
1,3-DIAMINE
A,B2B4B0.76
SPETHERMINEA,B319D0.7
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.74
DIPDIPENTYLAMINEC,D1A1B0.73
DIPDIPENTYLAMINEC,D1A070.73
DIPDIPENTYLAMINEC,D1A1A0.73
DIPDIPENTYLAMINEC,D1A080.73
DIPDIPENTYLAMINEC,D1A090.73
3CN3-AMINOPROPANEA,B,C,D3C0R0.71
3CN3-AMINOPROPANEB3BY40.71
ETNMETHYLETHYLAMINEA1TES0.79
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEB1O9M0.7
P241-(AMINOETHYL)AMINO-4-AMINOBUTANEA,B292D0.7
LYTBUTYLAMINEA1EAG0.72
TEATRIETHYLAMMONIUM IONA1BD10.81
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.71
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.71
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.71
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.71
2EP2-ETHYLPIPERIDINEH,I1A4W0.73
N3DN-methylpropane-1,3-diamineA,B3EY20.78
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.77