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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03524359

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.73
FPRPROPYLBENZENEC1RHK0.75
MBNTOLUENEA,B3D7O0.72
MBNTOLUENEA,B1R1X0.72
MBNTOLUENEA,B1JLX0.72
MBNTOLUENEA,B,C,D3D170.72
MBNTOLUENEA,B2VRL0.72
MBNTOLUENEA,I2Z3E0.72
MBNTOLUENEA,B1YZI0.72
MBNTOLUENEA,B2DN10.72
MBNTOLUENEA,B3EN10.72
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.71
PXYPARA-XYLENEA187L0.75
PXYPARA-XYLENEA225L0.75
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.76
OXEORTHO-XYLENEA,B3E0X0.78
OXEORTHO-XYLENEA188L0.78
AN3ANTHRACENEA,B2HMN0.87
AN3ANTHRACENEA,B2HMM0.87
PEYPHENANTHRENEA,B2HML0.87
PEYPHENANTHRENEA,B2HMK0.87
DENINDENEA183L0.72
I4BISOBUTYLBENZENEA184L0.75
NPYNAPHTHALENEA,B1O7G0.86
2HT3-methylbenzonitrileA,B3F880.82
PYLPHENYLETHANEC1B070.75
PYLPHENYLETHANEA,B2VRM0.75
PYLPHENYLETHANEA1NHB0.75
N4BN-BUTYLBENZENEA186L0.75
BDBA,B1KE30.76
FNP{[7-(DIFLUORO-PHOSPHONO-METHYL)-
NAPHTHALEN-2-YL]-DIFLUORO-METHYL}-
PHOSPHONIC ACID
A1KAK0.74