Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADCY6 | O43306 | 1/20 | 0.35 |
| ▸ | ADCY3 | O60266 | 1/20 | 0.35 |
| ▸ | ADCY9 | O60503 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9334046 | 0.98 | CA12 (0.41) | CA12CA1CA2CA9HTR2A | |
| SCHEMBL9334616 | 0.93 | MAPT (0.41) | CA12CA1CA2CA9HTR2A | |
| SCHEMBL31443901 | 0.87 | CA12 (0.46) | CA12CA1CA2CA9HTR2A | |
| SCHEMBL20877573 | 0.79 | KDM4E (0.49) | CA12CA1CA2CA9MAPT | |
| SCHEMBL10913812 | 0.79 | MAPT (0.47) | CA12CA1CA2CA9HTR2A | |
| SCHEMBL9331836 | 0.77 | CA12 (0.51) | CA12CA1CA2CA9MAPT | |
| SCHEMBL6167302 | 0.76 | ALDH1A1 (0.54) | HTR2AHTR2CHTR2BMAPTKDM4E | |
| SCHEMBL9331292 | 0.75 | HTR2C (0.54) | CA12CA1CA2CA9HTR2A | |
| SCHEMBL9331697 | 0.73 | MAPT (0.42) | CA12CA1CA2CA9MAPT | |
| Hydrochloric Acid SCHEMBL9331810 | 0.73 | HTR2C (0.53) | CA12CA1CA2CA9HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993000094-A2 | USE OF TETRAHYDROBENZAZEPINE DERIVATIVES FOR THE TREATMENT OF PORTAL HYPERTENSION AND MIGRAINE | SMITHKLINE BEECHAM PLC (GB) | 1993-01-07 | — | — | WO | disclosed |