Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | F13A1 | P00488 | 1/20 | 0.43 |
| ▸ | TGM2 | P21980 | 1/20 | 0.43 |
| ▸ | TGM1 | P22735 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7658562 | 0.79 | L3MBTL1 (0.68) | L3MBTL1ALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL3555080 | 0.78 | MAPT (0.49) | L3MBTL1ALDH1A1MEN1KMT2AGAA | |
| SCHEMBL23778959 | 0.78 | MEN1 (0.48) | L3MBTL1ALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL16217176 | 0.78 | MEN1 (0.48) | L3MBTL1MEN1KMT2ANPSR1TSHR | |
| SCHEMBL29946264 | 0.77 | MEN1 (0.45) | MEN1KMT2APOLBLMNAMAPT | |
| SCHEMBL4751287 | 0.77 | L3MBTL1 (0.46) | L3MBTL1ALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL31188036 | 0.75 | KDM4E (0.49) | L3MBTL1ALDH1A1KDM4EHSD17B10MEN1 | |
| SCHEMBL21854184 | 0.74 | MEN1 (0.50) | L3MBTL1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL1507302 | 0.74 | MEN1 (0.52) | L3MBTL1ALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL4820236 | 0.74 | LMNA (0.48) | ALDH1A1KDM4EHSD17B10MEN1KMT2A |
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-3122751-A1 | CONDENSED [1,4]DIAZEPINE COMPOUNDS AS AUTOTAXIN (ATX) AND LYSOPHOSPHATIDIC ACID (LPA) PRODUCTION INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2017-02-01 | — | — | EP | disclosed |
| WO-2015144609-A1 | CONDENSED [1,4]DIAZEPINE COMPOUNDS AS AUTOTAXIN (ATX) AND LYSOPHOSPHATIDIC ACID (LPA) PRODUCTION INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2015-10-01 | — | — | WO | disclosed |