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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03379018

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CI2(5BETA)-PREGNANE-3,20-DIONEA,C,D1XV90.71
CI2(5BETA)-PREGNANE-3,20-DIONEA,B3CAV0.71
ANO5-BETA-ANDROSTANE-3,17-DIONEH,L2O5Z0.72
ANO5-BETA-ANDROSTANE-3,17-DIONEH1DBK0.72
NCMNORCAMPHORA7CPP0.75
5SD5ALPHA-ANDROSTAN-3,17-DIONEA1QYW0.72
5SD5ALPHA-ANDROSTAN-3,17-DIONEA,B,C1OHS0.72
CAMCAMPHORA6CP40.89
CAMCAMPHORA,B2FEU0.89
CAMCAMPHORA1GEB0.89
CAMCAMPHORA3FWI0.89
CAMCAMPHORA2Z970.89
CAMCAMPHORA,B1O760.89
CAMCAMPHORA,B2A1N0.89
CAMCAMPHORA2QBO0.89
CAMCAMPHORA1AKD0.89
CAMCAMPHORA2CPP0.89
CAMCAMPHORA,B3FWG0.89
CAMCAMPHORA2QBM0.89
CAMCAMPHORA2ZAW0.89
CAMCAMPHORA1IWJ0.89
CAMCAMPHORA4CP40.89
CAMCAMPHORA3CPP0.89
CAMCAMPHORA1YRC0.89
CAMCAMPHORA2QBL0.89
CAMCAMPHORA,B1T860.89
CAMCAMPHORA1T850.89
CAMCAMPHORA,B1UYU0.89
CAMCAMPHORA2ZAX0.89
CAMCAMPHORA2ZWT0.89
CAMCAMPHORA,B1T880.89
CAMCAMPHORA5CP40.89
CAMCAMPHORA,B2A1O0.89
CAMCAMPHORA,B,K1DZ90.89
CAMCAMPHORA,B1T870.89
CAMCAMPHORA1YRD0.89
CAMCAMPHORA,B,K1DZ80.89
CAMCAMPHORA,B2A1M0.89
CAMCAMPHORA3FWJ0.89
CAMCAMPHORA2CP40.89
CAMCAMPHORA,B3FWF0.89
CAMCAMPHORA2QBN0.89
CAMCAMPHORA,B,K1DZ60.89
CAMCAMPHORA1IWI0.89
CAMCAMPHORA,B,K1DZ40.89
CAMCAMPHORA2ZWU0.89
ESRESTRADIOLA,B,C,D1OHP0.72