Deaminohydroxyvaline

Deaminohydroxyvaline

SCHEMBL8460958

CC(C)C(O)C(=O)O.CCCCC(O)C(=O)O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.64
FFAR1 O14842 1/20 0.64
CA2 P00918 1/20 0.45
MAPK1 P28482 1/20 0.45
TET2 Q6N021 3/20 0.40
KDM4A O75164 2/20 0.40
KDM4C Q9H3R0 2/20 0.40
KDM2A Q9Y2K7 2/20 0.40
TET3 O43151 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
MAPT P10636 1/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38

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
Hydrogen Peroxide SCHEMBL27840097 0.87 GPR84 (0.82) GPR84FFAR1CA2MAPK1TET2
SCHEMBL28555 0.87
SCHEMBL360108 0.87
SCHEMBL26184961 0.87 GPR84 (0.82) GPR84FFAR1CA2MAPK1TET2
SCHEMBL4378353 0.87
Lactic Acid SCHEMBL3038370 0.85 GPR84 (0.72) GPR84FFAR1CA2MAPK1TET2
SCHEMBL28425913 0.85 GPR84 (0.78) GPR84FFAR1CA2MAPK1TET2
Ethane SCHEMBL5400213 0.85 GPR84 (0.78) GPR84FFAR1CA2MAPK1TET2
SCHEMBL28800209 0.85 GPR84 (0.78) GPR84FFAR1CA2MAPK1TET2
SCHEMBL28848609 0.85 GPR84 (0.78) GPR84FFAR1CA2MAPK1TET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5989527-A Compositions and methods for improving the performance of chemical exfoliating agents, sunless tanning agents, skin lightening agents and insect repellents INOLEX INVESTMENT CORPORATION (US) 1999-11-23 US disclosed