Fragment: 8445e47e3713e67afc2ccda25fb138ed

SMILES: C=C1CC[C@@H]2CCCCC2[C@@H]1C/C=C1\CCOC1=O

Source Method: Murcko+BRICS

Fragment structure

Appears In Molecules

IDNameSMILESLink
CHEMBL186141 CHEMBL186141 C=C1CC[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]1C/C=C1/C(=O)OC[C@H]1O View

Associated Targets

TargetOrganismLink
Solute carrier organic anion transporter family member 1B3 Homo sapiens View
HK-2 Homo sapiens View
KBM5 Homo sapiens View
HuCC-A1 Homo sapiens View
AD293 Homo sapiens View
Hexokinase type II Homo sapiens View
Beta-glucosidase cytosolic Homo sapiens View
NF-kappaB inhibitor alpha Homo sapiens View
5637 Homo sapiens View
A2058 Homo sapiens View
A498 Homo sapiens View
Calu-3 Homo sapiens View
MDA-MB-361 Homo sapiens View
SGC-7901 Homo sapiens View
U-251 Homo sapiens View
NCI/ADR-RES Homo sapiens View
Col2 Homo sapiens View
NCI-H522 Homo sapiens View
SW-620 Homo sapiens View
Nuclear factor NF-kappa-B p65 subunit Homo sapiens View
Lu1 Homo sapiens View
Maltase-glucoamylase Homo sapiens View

Fragment–Molecule–Target Network

Fragment–Molecule Network