Fragment: b3d4d328c27cb45eab90ef4167635a42

SMILES: [13*][C@H]1C[C@H](O)[C@@H]([13*])O1

Source Method: Murcko+BRICS

Fragment structure

Appears In Molecules

IDNameSMILESLink
CHEMBL1580 CHEMBL1580 OC[C@H]1O[C@@H](n2cnc3c2N=CNC[C@H]3O)C[C@@H]1O View
CHEMBL917 CHEMBL917 O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1F View

Associated Targets

TargetOrganismLink
Multidrug resistance-associated protein 4 Homo sapiens View
SN12K1 Homo sapiens View
Multidrug resistance-associated protein 5 Homo sapiens View
Sodium- and chloride-dependent neutral and basic amino acid transporter B(0+) Homo sapiens View
Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 Homo sapiens View
Interleukin-8 receptor A Homo sapiens View
MAP kinase ERK1 Homo sapiens View
Thymidine phosphorylase Homo sapiens View
Tyrosine-protein kinase FYN Homo sapiens View
Leukocyte common antigen Homo sapiens View
Serine/threonine protein phosphatase 2B catalytic subunit, alpha isoform Homo sapiens View
Cytochrome P450 2E1 Homo sapiens View
Cytochrome P450 2A6 Homo sapiens View
143B Homo sapiens View
CCRF-CEM Homo sapiens View
CEM-TK(+) Homo sapiens View
COLO 320DM Homo sapiens View
DLD-1 Homo sapiens View
HT-1080 Homo sapiens View
KM12 Homo sapiens View
M14 Homo sapiens View
MKN-28 Homo sapiens View
MKN-45 Homo sapiens View
MOLT-4 Homo sapiens View
NHDF Homo sapiens View
NUGC-3 Homo sapiens View
OVCAR-4 Homo sapiens View
OVCAR-5 Homo sapiens View
OVCAR-8 Homo sapiens View
PANC-1 Homo sapiens View
Raji Homo sapiens View
Ramos Homo sapiens View
RXF 393 Homo sapiens View
SNB-19 Homo sapiens View
SW48 Homo sapiens View
T-24 Homo sapiens View
TK-10 Homo sapiens View
UACC-257 Homo sapiens View
UO-31 Homo sapiens View
ZR-75-1 Homo sapiens View
786-0 Homo sapiens View
791T cell line Homo sapiens View
A549 Homo sapiens View
AZ-521 cell line Homo sapiens View
NCI/ADR-RES Homo sapiens View
C170 Homo sapiens View
EKVX Homo sapiens View
NCI-H322M Homo sapiens View
HCC 2998 Homo sapiens View
HOP-18 Homo sapiens View
HOP-92 Homo sapiens View
TSU Homo sapiens View
KKLS Homo sapiens View
KM-20L2 Homo sapiens View
LNCaP Homo sapiens View
LOX IMVI Homo sapiens View
M19-MEL Homo sapiens View
MDA-N Homo sapiens View
Malme-3M Homo sapiens View
SNB-75 Homo sapiens View
NCI-H226 Homo sapiens View
NCI-H23 Homo sapiens View
NCI-H522 Homo sapiens View
BT-549 Homo sapiens View
SR Homo sapiens View
HCT-15 Homo sapiens View
Vasoactive intestinal polypeptide receptor 1 Homo sapiens View
Sodium/nucleoside cotransporter 2 Homo sapiens View
Canalicular multispecific organic anion transporter 2 Homo sapiens View
Adenosine deaminase Homo sapiens View
HMG-CoA reductase Homo sapiens View
Histamine H2 receptor Homo sapiens View
Monoamine oxidase B Homo sapiens View
Calcitonin receptor Homo sapiens View
Equilibrative nucleoside transporter 1 Homo sapiens View
Cysteinyl leukotriene receptor 1 Homo sapiens View
Cathepsin G Homo sapiens View
Oligopeptide transporter small intestine isoform Homo sapiens View
C-C chemokine receptor type 4 Homo sapiens View
Neuronal acetylcholine receptor protein alpha-4 subunit Homo sapiens View
Angiotensin II type 2 (AT-2) receptor Homo sapiens View
Interleukin-8 receptor B Homo sapiens View
Motilin receptor Homo sapiens View

Fragment–Molecule–Target Network

Fragment–Molecule Network