Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.51 |
| ▸ | BCHE | P06276 | 5/20 | 0.50 |
| ▸ | ACHE | P22303 | 3/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9762664 | 0.91 | SIGMAR1 (0.49) | SIGMAR1BCHEACHEMAOACHRM2 | |
| SCHEMBL9764536 | 0.91 | SCN8A (0.57) | SIGMAR1BCHEACHEMAOACHRM2 | |
| SCHEMBL9762667 | 0.90 | SLC2A1 (0.50) | SIGMAR1BCHEACHEMAOAKDM4E | |
| SCHEMBL9763305 | 0.88 | BCHE (0.46) | SIGMAR1BCHEACHEMAOACHRM2 | |
| SCHEMBL9762652 | 0.86 | POLB (0.51) | MAPK1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL10477755 | 0.85 | SIGMAR1 (0.69) | SIGMAR1BCHEMAOACHRM2MEN1 | |
| SCHEMBL9764394 | 0.85 | SIGMAR1 (0.69) | SIGMAR1BCHEMAOACHRM2MEN1 | |
| Hydrochloric Acid SCHEMBL9258435 | 0.84 | SIGMAR1 (0.67) | SIGMAR1BCHEMAOACHRM2MEN1 | |
| SCHEMBL9763689 | 0.84 | SIGMAR1 (0.52) | SIGMAR1BCHEACHEMAOACHRM2 | |
| SCHEMBL27716955 | 0.83 | SIGMAR1 (0.58) | SIGMAR1BCHEACHEMAOACHRM2 |
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 |