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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01086417

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
I4BISOBUTYLBENZENEA184L0.72
FPRPROPYLBENZENEC1RHK0.74
2HT3-methylbenzonitrileA,B3F880.85
OXEORTHO-XYLENEA,B3E0X0.72
OXEORTHO-XYLENEA188L0.72
PXYPARA-XYLENEA187L0.74
PXYPARA-XYLENEA225L0.74
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.82
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.72
MBNTOLUENEA,B3D7O0.76
MBNTOLUENEA,B1R1X0.76
MBNTOLUENEA,B1JLX0.76
MBNTOLUENEA,B,C,D3D170.76
MBNTOLUENEA,B2VRL0.76
MBNTOLUENEA,I2Z3E0.76
MBNTOLUENEA,B1YZI0.76
MBNTOLUENEA,B2DN10.76
MBNTOLUENEA,B3EN10.76
N4BN-BUTYLBENZENEA186L0.74
PIHIODOPHENYLA1UO50.72
PIHIODOPHENYLA3DNA0.72
PIHIODOPHENYLA1F9O0.72
PIHIODOPHENYLA,B1UO40.72
PIHIODOPHENYLA3DN40.72
PYLPHENYLETHANEC1B070.74
PYLPHENYLETHANEA,B2VRM0.74
PYLPHENYLETHANEA1NHB0.74
IBZ2-IODOBENZYLTHIO GROUPA,B1CEL0.76