Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | SAT1 | P21673 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22813553 | 1.00 | IRAK4 (0.36) | IRAK4ALDH1A1EPHX1MEN1KMT2A | |
| SCHEMBL19406900 | 1.00 | IRAK4 (0.36) | IRAK4ALDH1A1EPHX1MEN1KMT2A | |
| SCHEMBL23906651 | 1.00 | IRAK4 (0.36) | IRAK4ALDH1A1EPHX1MEN1KMT2A | |
| SCHEMBL20106253 | 0.91 | EPHX1 (0.41) | ALDH1A1EPHX1POLBTSHRJAK1 | |
| SCHEMBL23906655 | 0.91 | EPHX1 (0.36) | IRAK4ALDH1A1EPHX1MEN1KMT2A | |
| SCHEMBL1678728 | 0.87 | — | — | |
| SCHEMBL23943526 | 0.85 | OPRL1 (0.37) | IRAK4 | |
| SCHEMBL15906220 | 0.82 | KDM1A (0.35) | ALDH1A1EPHX1POLBRECQL | |
| SCHEMBL19406793 | 0.80 | HTT (0.36) | IRAK4SAT1TDP1JAK1 | |
| SCHEMBL20991719 | 0.79 | ADH1B (0.39) | EPHX1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-8461328-B2 | Tricyclic heterocyclic compounds, compositions and methods of use thereof | GENENTECH, INC. (US) | 2013-06-11 | — | — | US | disclosed |
| WO-2013026163-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-02-28 | — | — | WO | disclosed |