Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 13/20 | 0.55 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 9/20 | 0.51 |
| ▸ | TUBB | P07437 | 9/20 | 0.51 |
| ▸ | TUBA3C | P0DPH7 | 9/20 | 0.51 |
| ▸ | TUBA1B | P68363 | 9/20 | 0.51 |
| ▸ | TUBA4A | P68366 | 9/20 | 0.51 |
| ▸ | TUBB4B | P68371 | 9/20 | 0.51 |
| ▸ | TUBB3 | Q13509 | 9/20 | 0.51 |
| ▸ | TUBB2A | Q13885 | 9/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9763615 | 1.00 | TUBB1 (0.55) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL2004805 | 0.87 | CYP1A1 (0.58) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL30887916 | 0.87 | CYP1A1 (0.58) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL4299632 | 0.87 | CYP1A1 (0.58) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL29565593 | 0.85 | CYP1A1 (0.56) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL9129554 | 0.82 | CYP1A1 (0.53) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL9129548 | 0.82 | CYP1A1 (0.53) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL5691704 | 0.82 | CYP1A1 (0.53) | TUBB1CYP1A1CYP1A2CYP1B1GAA | |
| SCHEMBL2684387 | 0.81 | CYP1A1 (0.57) | TUBB1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL15690219 | 0.81 | TUBB1 (0.53) | TUBB1CYP1A1CYP1A2CYP1B1GAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4990505-A | Treating asthma, bronchitis; adrenergic stimulants | GLAXO GROUP LIMITED (GB) | 1991-02-05 | — | — | US | disclosed |