Valine

Valine

SCHEMBL869350

C1=CCC=CC1.CC(C)[C@H](N)C(=O)O

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.71
SLC1A3 P43003 3/20 0.38
SLC1A2 P43004 3/20 0.38
SLC1A1 P43005 3/20 0.38
DPP4 P27487 3/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
TP53 P04637 1/20 0.33
NR1I2 O75469 1/20 0.33
PTGS1 P23219 1/20 0.33
ADRA1A P35348 1/20 0.33
ACHE P22303 1/20 0.33
LMNA P02545 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
FAP Q12884 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
LAP3 P28838 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
Valine SCHEMBL4582565 0.85 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL28052598 0.85 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL288203 0.84 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL31618928 0.84
Valine SCHEMBL29828716 0.84
Valine SCHEMBL41225 0.84 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL2785563 0.84 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL8516 0.84
Valine SCHEMBL1813972 0.84 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1DPP4
Valine SCHEMBL8515 0.84

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729283-B2 Chain-selective synthesis of fuel components and chemical feedstocks ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION (US) 2014-05-20 US disclosed
US-20130130336-A1 CHAIN-SELECTIVE SYNTHESIS OF FUEL COMPONENTS AND CHEMICAL FEEDSTOCKS ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION (US) 2013-05-23 US disclosed
US-8420840-B2 Chain-selective synthesis of fuel components and chemical feedstocks ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION 2013-04-16 US disclosed
US-20120077235-A1 CHAIN-SELECTIVE SYNTHESIS OF FUEL COMPONENTS AND CHEMICAL FEEDSTOCKS OLSON EDWIN S (US) 2012-03-29 US disclosed
US-8071799-B2 Chain-selective synthesis of fuel components and chemical feedstocks ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION (US) 2011-12-06 US disclosed
WO-2010123589-A2 CHAIN-SELECTIVE SYNTHESIS OF FUEL COMPONENTS AND CHEMICAL FEEDSTOCKS ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION (US) 2010-10-28 WO disclosed
US-20100191008-A1 CHAIN-SELECTIVE SYNTHESIS OF FUEL COMPONENTS AND CHEMICAL FEEDSTOCKS ENERGY & ENVIRONMENTAL RESEARCH CENTER FOUNDATION (US) 2010-07-29 US disclosed