Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 8/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 8/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL98657 | 0.77 | ALDH1A1 (0.58) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL3701501 | 0.75 | CYP2A6 (0.50) | ALDH1A1KDM4EFBP1 | |
| SCHEMBL10661016 | 0.72 | ALDH1A1 (0.54) | ALDH1A1CYP1A1CYP1A2CYP1B1SLC6A4 | |
| SCHEMBL195687 | 0.72 | ALDH1A1 (1.00) | ALDH1A1CYP1A1CYP1A2CYP1B1FBP1 | |
| SCHEMBL8965531 | 0.71 | ALDH1A1 (0.52) | ALDH1A1CYP1A2SLC6A4KDM4EMAOA | |
| SCHEMBL16709773 | 0.71 | ALDH1A1 (0.52) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL8367958 | 0.71 | CYP1A1 (0.71) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL7567897 | 0.71 | CYP1A1 (0.71) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL11613661 | 0.71 | ALDH1A1 (0.64) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E | |
| SCHEMBL13790243 | 0.71 | CYP1A1 (0.71) | ALDH1A1CYP1A1CYP1A2CYP1B1KDM4E |
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-4845100-A | WITH HYPOTENSIVE AND ANTIINFLAMMATORY ACTIVITY | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1989-07-04 | — | — | US | disclosed |
| EP-0202760-A2 | Carbostyril derivatives and salts thereof, processes for preparing the same and cardiotonic composition containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1986-11-26 | — | — | EP | disclosed |