Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4409185 | 0.84 | ALDH1A1 (0.42) | ALDH1A1HTR1AKMT2AMEN1LMNA | |
| SCHEMBL4404245 | 0.82 | ALDH1A1 (0.41) | ALDH1A1HTR1AKMT2AMEN1LMNA | |
| SCHEMBL4409151 | 0.81 | ALDH1A1 (0.40) | ALDH1A1LMNA | |
| SCHEMBL6474091 | 0.80 | ALDH1A1 (0.36) | ALDH1A1HTR1ALMNANPSR1L3MBTL1 | |
| SCHEMBL4408138 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HTR1AKMT2AMEN1LMNA | |
| SCHEMBL14727991 | 0.79 | — | — | |
| SCHEMBL4033007 | 0.76 | ALDH1A1 (0.42) | ALDH1A1HTR1AKMT2AMEN1LMNA | |
| SCHEMBL8464715 | 0.75 | ALDH1A1 (0.38) | ALDH1A1HTR1AKMT2AMEN1 | |
| SCHEMBL10675479 | 0.75 | ALDH1A1 (0.36) | ALDH1A1HTR1AKMT2AMEN1 | |
| SCHEMBL2056129 | 0.74 | — | — |
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-4277479-A | ANTI-ASTHMATIC, HYPOTENSIVE, ANTI-ULCER, ANTIINFLAMMATORY, VASODILATION, ENZYME INHIBITORS, ANTICOAGULANTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1981-07-07 | — | — | US | disclosed |