Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | CCR8 | P51685 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23120768 | 0.87 | TSHR (0.44) | ALDH1A1NPSR1MAPTHSD17B10 | |
| SCHEMBL157235 | 0.87 | L3MBTL1 (0.47) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL159264 | 0.83 | KDM4E (0.47) | POLBMAPT | |
| SCHEMBL7804819 | 0.80 | MEN1 (0.55) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL21428186 | 0.76 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL3541508 | 0.76 | L3MBTL1 (0.53) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL18604604 | 0.75 | ALDH1A1 (0.40) | ALDH1A1MEN1KMT2APOLBMAPT | |
| SCHEMBL69190 | 0.74 | MAPT (0.43) | ALDH1A1MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL23121296 | 0.74 | CHRNB2 (0.44) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL13699375 | 0.73 | CA12 (0.50) | ALDH1A1MEN1KMT2APOLBPKM |
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-2613782-A2 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-07-17 | — | — | EP | disclosed |
| WO-2012030685-A2 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-03-08 | — | — | WO | disclosed |