Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL1604291 | 1.00 | FAAH (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL1604293 | 1.00 | FAAH (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL14764653 | 0.97 | CA12 (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL14764654 | 0.97 | CA12 (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL15912664 | 0.97 | CA12 (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL13491291 | 0.91 | ADORA3 (0.43) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL30517275 | 0.91 | G6PD (0.44) | CA12CA1CA9CYP2D6KEAP1 | |
| SCHEMBL30821470 | 0.90 | ALDH1A1 (0.40) | FAAHCA12CA1CA9CYP2D6 | |
| SCHEMBL10731427 | 0.89 | ALDH1A1 (0.43) | FAAHALDH1A1FFAR1MAPTCYP19A1 | |
| SCHEMBL7268342 | 0.88 | CYP24A1 (0.40) | CA12CA1CA9CYP2D6KEAP1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2483233-A2 | HETEROATOM CONTAINING SUBSTITUTED FATTY ACIDS | Miller, Raymond A. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041639-A2 | HETEROATOM CONTAINING SUBSTITUTED FATTY ACIDS | MILLER RAYMOND A (US) | 2011-04-07 | — | — | WO | disclosed |