Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22349071 | 0.85 | ALDH1A1 (0.33) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL12872465 | 0.76 | HRH3 (0.33) | SLC6A4HRH3 | |
| SCHEMBL12712697 | 0.75 | CNR2 (0.37) | SLC6A4HRH3 | |
| SCHEMBL9911374 | 0.75 | ALDH1A1 (0.45) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL9911378 | 0.75 | ALDH1A1 (0.41) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL22924117 | 0.75 | ALDH1A1 (0.37) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL20963278 | 0.75 | HRH3 (0.38) | SLC6A4HRH3 | |
| SCHEMBL9911373 | 0.74 | ALDH1A1 (0.44) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL9911372 | 0.74 | ALDH1A1 (0.35) | SLC6A4HRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL18872038 | 0.74 | HRH3 (0.39) | SLC6A4HRH3ALDH1A1SMN1; SMN2 |
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-8198458-B2 | Non-nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-12 | — | — | US | disclosed |
| US-7517998-B2 | Benzothiazole or benzothiazine derivative of dipyrido(2,3;b:2',3'-e) diazepin-6-one; viricide against human t-cell leukemia/lymphoma virus | BOEHRINGER INGELHEIM INTERNATIONAL GMBH | 2009-04-14 | — | — | US | disclosed |
| US-7517998-B2 | Benzothiazole or benzothiazine derivative of dipyrido(2,3;b:2',3'-e) diazepin-6-one; viricide against human t-cell leukemia/lymphoma virus | BOEHRINGER INGELHEIM INTERNATIONAL GMBH | 2009-04-14 | — | — | US | disclosed |