Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.37 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31682124 | 0.81 | CSNK1E (0.45) | AOC3CSNK1ENAAAALDH1A1KDM4E | |
| SCHEMBL6931356 | 0.79 | CACNA2D1 (0.50) | AOC3CSNK1ENAAAALDH1A1KDM4E | |
| SCHEMBL766022 | 0.79 | — | — | |
| SCHEMBL235985 | 0.79 | — | — | |
| SCHEMBL134483 | 0.79 | — | — | |
| SCHEMBL15283559 | 0.77 | GPR84 (0.45) | KDM4ELMNAPOLBCYP1A2CYP3A4 | |
| SCHEMBL6285996 | 0.77 | GPR84 (0.45) | KDM4ELMNAPOLBCYP1A2CYP3A4 | |
| SCHEMBL12994143 | 0.77 | GPR84 (0.45) | KDM4ELMNAPOLBCYP1A2CYP3A4 | |
| SCHEMBL9793919 | 0.77 | GPR84 (0.45) | KDM4ELMNAPOLBCYP1A2CYP3A4 | |
| SCHEMBL1888013 | 0.77 | GPR84 (0.45) | KDM4ELMNAPOLBCYP1A2CYP3A4 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6660072-B2 | An acetylenic alcohol stabilizer for corrosion resistance | HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. | 2003-12-09 | — | — | US | disclosed |