Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL67968 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL5702841 | 0.83 | TSHR (0.37) | TDP1TSHRLMNAALOX12ACHE | |
| Ammonia Solution, Strong SCHEMBL28586237 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL7937814 | 0.83 | TSHR (0.37) | TDP1TSHRLMNAALOX12ACHE | |
| Fluoride SCHEMBL29655462 | 0.83 | — | — | |
| SCHEMBL9718210 | 0.83 | TSHR (0.37) | TDP1TSHRLMNAALOX12ACHE | |
| Hydrochloric Acid SCHEMBL5165959 | 0.80 | TSHR (0.35) | TDP1TSHRLMNAALOX12ACHE | |
| SCHEMBL28535293 | 0.80 | TSHR (0.36) | TRPA1TSHRLMNAALOX12ACHE | |
| Trimethylammonium SCHEMBL11075798 | 0.78 | TSHR (0.36) | TDP1TAAR1SIGMAR1TSHRLMNA | |
| SCHEMBL7785325 | 0.78 | TSHR (0.35) | TSHRLMNAALOX12ACHE |
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-20090326097-A1 | SURFACE-COATED ALUMINUM OXIDE NANOPARTICLE AND RESIN COMPOSITION THEREOF | NISSAN MOTOR CO., LTD. | 2009-12-31 | — | — | US | disclosed |
| EP-2048189-A1 | SURFACE-COATED ALUMINUM OXIDE NANOPARTICLE AND RESIN COMPOSITION THEREOF | Nissan Motor Co., Ltd. (JP) | 2009-04-15 | — | — | EP | disclosed |