Threonine

Threonine

SCHEMBL3408904

CCc1c(F)ccc(C#N)c1Cl.C[C@H](O)[C@@H](N)C(=O)O

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.35
CYP2D6 P10635 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
NOS2 P35228 2/20 0.33
TNF P01375 1/20 0.33
S1PR3 Q99500 1/20 0.33
GRIA2 P42262 1/20 0.32
GRIA4 P48058 1/20 0.32
MET P08581 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
PGR P06401 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1363736 0.80 AR (0.44) AR
SCHEMBL1364419 0.72 AR (0.37) ARPGR
SCHEMBL1364311 0.72 AR (0.37) ARPGR
SCHEMBL221854 0.69 AR (0.42) AR
SCHEMBL3333067 0.68 AR (0.41) ARS1PR3
SCHEMBL10878832 0.68 AR (0.45) ARPGR
SCHEMBL20889366 0.67 AR (0.36) ARS1PR3SLC1A3SLC1A2SLC1A1
SCHEMBL12140367 0.67 AR (0.40) ARPGR
SCHEMBL19682367 0.67 AR (0.36) ARS1PR3SLC1A3SLC1A2SLC1A1
SCHEMBL24495512 0.67 AKR1B1 (0.41) ARCYP2D6SLC6A2SLC6A4NOS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2260028-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS Radius Health, Inc. (US) 2010-12-15 EP disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 WO disclosed