Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL11215757 | 0.85 | ALDH1A1 (0.44) | CYP1A2L3MBTL1ALDH1A1GAAMAPK1 | |
| SCHEMBL11210678 | 0.75 | HSD17B10 (0.44) | CYP1A2ALDH1A1GAAMAPK1HSD17B10 | |
| SCHEMBL25683002 | 0.71 | L3MBTL1 (0.61) | L3MBTL1ALDH1A1GAAP2RX7MAPT | |
| SCHEMBL11207896 | 0.69 | MAPK1 (0.44) | ALDH1A1GAAMAPK1HSD17B10POLB | |
| SCHEMBL13994041 | 0.67 | L3MBTL1 (0.56) | L3MBTL1ALDH1A1P2RX7MAPTMEN1 | |
| SCHEMBL11544897 | 0.67 | MAPK1 (0.62) | CYP1A2ALDH1A1GAAMAPK1HSD17B10 | |
| SCHEMBL5419568 | 0.67 | NPC1 (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2ARAB9A | |
| SCHEMBL29769140 | 0.66 | CHEK1 (0.58) | L3MBTL1ALDH1A1GAAMAPK1MAPT | |
| SCHEMBL8404434 | 0.66 | CHEK1 (0.58) | L3MBTL1ALDH1A1GAAMAPK1MAPT | |
| SCHEMBL18167974 | 0.66 | L3MBTL1 (0.68) | L3MBTL1ALDH1A1MAPTMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4086353-A | MYOTONOLYTICS, HYPOTENSIVES, ANTISPASMODICS, MUSCLE RELAXANTS | SANDOZ LTD. (CH) | 1978-04-25 | — | — | US | claimed |
| US-4333945-A | Thiazoline and imidazoline derivatives useful as minor tranquilizers | SANDOZ LTD. (CH) | 1982-06-08 | — | — | US | disclosed |
| US-4086353-A | MYOTONOLYTICS, HYPOTENSIVES, ANTISPASMODICS, MUSCLE RELAXANTS | SANDOZ LTD. (CH) | 1978-04-25 | — | — | US | disclosed |