Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 5/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | PRKX | P51817 | 1/20 | 0.45 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9803136 | 0.86 | ALDH1A1 (0.59) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL9558724 | 0.84 | TDP1 (0.49) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL6098672 | 0.83 | PTPN1 (0.48) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL6098677 | 0.83 | PTPN1 (0.48) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL17658995 | 0.83 | ALOX5 (0.58) | ALDH1A1SMN1; SMN2HIF1AMAOBMAOA | |
| SCHEMBL8730039 | 0.82 | TDP1 (0.57) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL30628474 | 0.82 | TDP1 (0.57) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL8730031 | 0.82 | TDP1 (0.57) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL21657603 | 0.82 | TDP1 (0.57) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL29721135 | 0.82 | TDP1 (0.57) | TDP1ALDH1A1SMN1; SMN2TP53CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4336267-A | Heart active compounds and methods of use | AKTIEBOLAGET HASSLE (SE) | 1982-06-22 | — | — | US | disclosed |
| US-4244969-A | (P-HYDROXYPHENOXY)PROPANOLAMINE DERIVATIVES USEFUL AS B-RECEPTOR STIMULANTS | AKTIEBOLAGET HASSLE (SE) | 1981-01-13 | — | — | US | disclosed |