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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021421

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PXYPARA-XYLENEA187L0.7
PXYPARA-XYLENEA225L0.7
2HT3-methylbenzonitrileA,B3F880.73
FPRPROPYLBENZENEC1RHK0.7
PBCPHENYL BORONIC ACIDA2A320.74
PBCPHENYL BORONIC ACIDA1JU30.74
PA0Phenylarsine oxideA3E3Z0.77
BNZBENZENEA1L830.78
BNZBENZENEA1CP40.78
BNZBENZENEA,B,C,D1XXJ0.78
BNZBENZENEB1SWI0.78
BNZBENZENEA181L0.78
BNZBENZENEA223L0.78
BNZBENZENEA3DMX0.78
BNZBENZENEA2Z9G0.78
BNZBENZENEA220L0.78
BNZBENZENEA227L0.78
BNZBENZENEA,B1A7Z0.78
BNZBENZENEA1L840.78
PYLPHENYLETHANEC1B070.7
PYLPHENYLETHANEA,B2VRM0.7
PYLPHENYLETHANEA1NHB0.7
PIHIODOPHENYLA1UO50.74
PIHIODOPHENYLA3DNA0.74
PIHIODOPHENYLA1F9O0.74
PIHIODOPHENYLA,B1UO40.74
PIHIODOPHENYLA3DN40.74
PHGPHENYLMERCURYA1CZS0.78
N4BN-BUTYLBENZENEA186L0.7
P4PTETRAPHENYLPHOSPHONIUMA,M1EXJ0.73
P4PTETRAPHENYLPHOSPHONIUMA,C3B620.73
P4PTETRAPHENYLPHOSPHONIUMA,B1R8E0.73
P4PTETRAPHENYLPHOSPHONIUMA2BOW0.73
P4PTETRAPHENYLPHOSPHONIUMA3B5D0.73