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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00057687

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2HT3-methylbenzonitrileA,B3F880.84
I4BISOBUTYLBENZENEA184L0.72
PXYPARA-XYLENEA187L0.72
PXYPARA-XYLENEA225L0.72
2631-(azidomethyl)-3-methylbenzeneX2RB20.7
FPRPROPYLBENZENEC1RHK0.72
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.7
MBNTOLUENEA,B3D7O0.71
MBNTOLUENEA,B1R1X0.71
MBNTOLUENEA,B1JLX0.71
MBNTOLUENEA,B,C,D3D170.71
MBNTOLUENEA,B2VRL0.71
MBNTOLUENEA,I2Z3E0.71
MBNTOLUENEA,B1YZI0.71
MBNTOLUENEA,B2DN10.71
MBNTOLUENEA,B3EN10.71
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.73
N4BN-BUTYLBENZENEA186L0.72
PYLPHENYLETHANEC1B070.72
PYLPHENYLETHANEA,B2VRM0.72
PYLPHENYLETHANEA1NHB0.72