Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 13/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11210678 | 0.84 | HSD17B10 (0.44) | MAPK1HSD17B10ADRA2AADRA2BADRA2C | |
| SCHEMBL11215757 | 0.74 | ALDH1A1 (0.44) | MAPK1HSD17B10ADRA2AADRA2BADRA2C | |
| SCHEMBL11608723 | 0.74 | ADRA2A (0.42) | ADRA2AADRA2BADRA2CADRA1AROCK1 | |
| SCHEMBL11214565 | 0.69 | CYP1A2 (0.48) | MAPK1HSD17B10ALDH1A1POLBGAA | |
| SCHEMBL18056290 | 0.63 | ROCK1 (0.57) | ROCK1ROCK2 | |
| SCHEMBL24094239 | 0.62 | ROCK1 (0.40) | ROCK1ROCK2 | |
| SCHEMBL10172282 | 0.62 | NOS1 (0.50) | ROCK1 | |
| SCHEMBL5412653 | 0.62 | NOS1 (0.50) | MAPK1 | |
| SCHEMBL18038216 | 0.62 | NOS1 (0.50) | HSD17B10ALDH1A1ROCK1ROCK2HPGD | |
| SCHEMBL25396754 | 0.62 | NOS1 (0.50) | ALDH1A1ROCK1ROCK2HPGDGAA |
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-4333945-A | Thiazoline and imidazoline derivatives useful as minor tranquilizers | SANDOZ LTD. (CH) | 1982-06-08 | — | — | US | disclosed |
| US-4329354-A | HAVING A 2,1,3-BENZOTHIADIAZOLE COMPONENT | SANDOZ LTD. (CH) | 1982-05-11 | — | — | US | disclosed |