Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 8/20 | 0.49 |
| ▸ | TSPO | P30536 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.44 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.43 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.41 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31078354 | 0.85 | TSHR (0.56) | MRGPRX1TSPOHCRTR1TSHRL3MBTL1 | |
| SCHEMBL30628345 | 0.85 | CYP3A4 (0.61) | MRGPRX1TSPOHCRTR1CYP3A4TSHR | |
| SCHEMBL1188345 | 0.85 | TSHR (0.56) | MRGPRX1TSPOHCRTR1TSHRL3MBTL1 | |
| SCHEMBL3165420 | 0.85 | CYP3A4 (0.61) | MRGPRX1TSPOHCRTR1CYP3A4TSHR | |
| SCHEMBL20472214 | 0.84 | MEN1 (0.51) | CYP3A4ALDH1A1 | |
| SCHEMBL31565683 | 0.83 | MAPK1 (0.50) | MRGPRX1TSPOHCRTR1CYP3A4TSHR | |
| SCHEMBL4729840 | 0.81 | KDM4E (0.57) | HCRTR1CYP3A4TSHRL3MBTL1ALDH1A1 | |
| SCHEMBL15423768 | 0.81 | KCNMA1 (0.48) | MRGPRX1HCRTR1CYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL3385153 | 0.81 | TSHR (0.50) | MRGPRX1TSHRSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL30102496 | 0.81 | NPC1 (0.50) | HCRTR1CYP3A4TSHRSMN1; SMN2L3MBTL1 |
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-4336400-A | BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS | STERLING DRUG INC. (US) | 1982-06-22 | — | — | US | disclosed |
| US-RE30241-E | BRONCHODILATION, ADRENERGIC STIMULANTS | STERLING DRUG INC. (US) | 1980-03-25 | — | — | US | disclosed |
| US-4138581-A | BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS | STERLING DRUGS INC. (US) | 1979-02-06 | — | — | US | disclosed |