2-Ethylhexanoic Acid

2-Ethylhexanoic Acid

SCHEMBL6130020

CCCCC(CC)C(=O)O.[Ge]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.95
MAPK1 P28482 2/20 0.95
CA1 P00915 4/20 0.61
SLC1A2 P43004 3/20 0.59
SLC1A1 P43005 3/20 0.59
SLC1A3 P43003 2/20 0.59
CHRM1 P11229 1/20 0.54
AKR1A1 P14550 1/20 0.54
CHRM3 P20309 1/20 0.54
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
ADRA1A P35348 1/20 0.54
HRH1 P35367 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC2 Q92769 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
GRIK1 P39086 2/20 0.52
GRIK2 Q13002 2/20 0.52

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
2-Ethylhexanoic Acid SCHEMBL282014 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8387406 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL8375903 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5512393 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL25800 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL301319 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL5695779 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL6121661 0.98 CA2 (1.00) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL23045110 0.95 CA2 (0.95) CA2MAPK1CA1SLC1A2SLC1A1
2-Ethylhexanoic Acid SCHEMBL21054918 0.95 CA2 (0.95) CA2MAPK1CA1SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1330669-A4 OPTICAL WAVEGUIDES AND INTEGRATED OPTICAL SUBSYSTEMS ON-A-CHIP NGIMAT CO (US) 2005-11-09 EP disclosed
US-6954570-B2 Optical waveguides and integrated optical subsystems on-a-chip NGIMAT CO. (US) 2005-10-11 US disclosed
EP-1330669-A1 OPTICAL WAVEGUIDES AND INTEGRATED OPTICAL SUBSYSTEMS ON-A-CHIP MicroCoating Technologies, Inc. (US) 2003-07-30 EP disclosed
WO-2002031557-A1 OPTICAL WAVEGUIDES AND INTEGRATED OPTICAL SUBSYSTEMS ON-A-CHIP MICROCOATING TECHNOLOGIES, INC. (US) 2002-04-18 WO disclosed