Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | MC3R | P41968 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RBBP9 | O75884 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL157088 | 0.81 | — | — | |
| SCHEMBL158422 | 0.81 | — | — | |
| SCHEMBL31461088 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL27718659 | 0.79 | — | — | |
| Potassium SCHEMBL31461086 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL28224778 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL5013504 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRL3MBTL1CYP2D6CYP2C19 | |
| SCHEMBL31461084 | 0.79 | — | — | |
| SCHEMBL28853121 | 0.77 | TSHR (0.45) | ALDH1A1TSHRATML3MBTL1ADORA3 | |
| Ammonia Solution, Strong SCHEMBL28224779 | 0.77 | ALDH1A1 (0.57) | ALDH1A1TSHRL3MBTL1CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105873925-B | Antiparasitic and insecticidal isoxazoline compounds | 勃林格殷格翰动物保健美国公司 | 2019-09-10 | — | — | CN | disclosed |
| CN-105873925-A | Antiparasitic and insecticidal isoxazoline compounds | 梅里亚股份有限公司 | 2016-08-17 | — | — | CN | disclosed |