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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00058012

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
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.76
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.72
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.71
FPRPROPYLBENZENEC1RHK0.7
HY1PHENYLACETALDEHYDED,H2I0S0.72
HY1PHENYLACETALDEHYDEA,B1D6Y0.72
HY1PHENYLACETALDEHYDEA,B1D6Z0.72
HY1PHENYLACETALDEHYDED,H2OK40.72
HY1PHENYLACETALDEHYDEA,B1D6U0.72
2602-(bromomethyl)-1,3-difluorobenzeneX2RB00.71
BZQDIPHENYLMETHANONEA,B1GT50.76
BZQDIPHENYLMETHANONEA,B1DZP0.76
1LPTRANYLCYPROMINEA,B1OJB0.7
I4BISOBUTYLBENZENEA184L0.71
AC01-PHENYLETHANONEA1ZK10.79
AC01-PHENYLETHANONEA1ZK40.79
CVB4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACIDA,B1KE00.71
HPK(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATEA2PUH0.72
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B2OK90.79
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B1Z760.79
PBP1-(4-BROMO-PHENYL)-ETHANONEA1BK90.79
3PL3-PHENYLPROPANALE1Y3G0.73
HBXbenzaldehydeA,B3GDN0.72
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE60.72
TCAPHENYLETHYLENECARBOXYLIC ACIDA1BE80.72
TCAPHENYLETHYLENECARBOXYLIC ACIDA,B,C,D,E,F,
G,H
2O780.72
PYLPHENYLETHANEC1B070.7
PYLPHENYLETHANEA,B2VRM0.7
PYLPHENYLETHANEA1NHB0.7
N4BN-BUTYLBENZENEA186L0.7
VK3MENADIONEA1TUV0.72
VK3MENADIONEA,B2QR20.72