Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7945223 | 0.84 | TSHR (0.49) | TSHRL3MBTL1TDP1RAB9ALMNA | |
| SCHEMBL291697 | 0.84 | L3MBTL1 (0.59) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| SCHEMBL17709227 | 0.83 | NPC1 (0.60) | TSHRL3MBTL1NPC1RAB9ALMNA | |
| Propiophenone SCHEMBL28867193 | 0.83 | ALDH1A1 (0.55) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| SCHEMBL1742078 | 0.81 | TSHR (0.49) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| Phenol SCHEMBL2362180 | 0.80 | TSHR (0.59) | TSHRL3MBTL1TDP1LMNAALDH1A1 | |
| Propiophenone SCHEMBL28515262 | 0.79 | TSHR (0.53) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| SCHEMBL648865 | 0.79 | TSHR (0.53) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| Hydrogen Peroxide SCHEMBL28876079 | 0.79 | LMNA (0.59) | TSHRL3MBTL1TDP1NPC1RAB9A | |
| SCHEMBL28120430 | 0.79 | LMNA (0.59) | TSHRL3MBTL1TDP1NPC1RAB9A |
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-5968975-A | TREATING ATHEROSCLEROSIS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-10-19 | — | — | US | disclosed |
| WO-1998057925-A1 | ELEVATION OF HDL CHOLESTEROL BY 2-[(AMINOTHIOXOMETHYL)-HYDRAZONO]-2-ARYLETHYL CARBAMATES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-12-23 | — | — | WO | disclosed |