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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03298327

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SMLPHENYL METHYL SULFONEA,I1D6W0.7
SMLPHENYL METHYL SULFONEA,I1D9I0.7
FPRPROPYLBENZENEC1RHK0.73
TLD4-methylbenzene-1,2-dithiolA2Z940.74
IBZ2-IODOBENZYLTHIO GROUPA,B1CEL0.73
PXYPARA-XYLENEA187L0.73
PXYPARA-XYLENEA225L0.73
MBNTOLUENEA,B3D7O0.73
MBNTOLUENEA,B1R1X0.73
MBNTOLUENEA,B1JLX0.73
MBNTOLUENEA,B,C,D3D170.73
MBNTOLUENEA,B2VRL0.73
MBNTOLUENEA,I2Z3E0.73
MBNTOLUENEA,B1YZI0.73
MBNTOLUENEA,B2DN10.73
MBNTOLUENEA,B3EN10.73
PYLPHENYLETHANEC1B070.73
PYLPHENYLETHANEA,B2VRM0.73
PYLPHENYLETHANEA1NHB0.73
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.83
HZH1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan-
2-one
A,B3DEA0.78
I4BISOBUTYLBENZENEA184L0.71
N4BN-BUTYLBENZENEA186L0.73
OXEORTHO-XYLENEA,B3E0X0.71
OXEORTHO-XYLENEA188L0.71
2602-(bromomethyl)-1,3-difluorobenzeneX2RB00.72
2IB2-IODOBENZYL GROUPI,J,K,L,M,N,
O,P
1GUL0.71