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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01084786

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B3FKV0.72
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B1C3B0.72
I4BISOBUTYLBENZENEA184L0.72
TSUPARA-TOLUENE SULFONATEA,B1WUW0.71
TSUPARA-TOLUENE SULFONATEA1B0D0.71
PXYPARA-XYLENEA187L0.72
PXYPARA-XYLENEA225L0.72
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.7
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.7
FPRPROPYLBENZENEC1RHK0.72
TLD4-methylbenzene-1,2-dithiolA2Z940.77
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
BPSA,B2DE40.75
N4BN-BUTYLBENZENEA186L0.72
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.79
TOSP-SULFINOTOLUENEH1ETT0.72
TOSP-SULFINOTOLUENEI4PAD0.72
TOSP-SULFINOTOLUENEA1EST0.72
TOSP-SULFINOTOLUENEC,G2CHA0.72
TOSP-SULFINOTOLUENEE1PPH0.72
BDBA,B1KE30.71
PYLPHENYLETHANEC1B070.72
PYLPHENYLETHANEA,B2VRM0.72
PYLPHENYLETHANEA1NHB0.72
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.77