Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL9205430 | 0.81 | ELANE (0.37) | ACHETSHRALDH1A1ATMCYP1A2 | |
| SCHEMBL31276071 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KDM4EGAAHSD17B10TP53 | |
| SCHEMBL17166803 | 0.79 | CYP2A6 (0.43) | ACHETSHRALDH1A1ATMCYP1A2 | |
| SCHEMBL22289608 | 0.77 | CD44 (0.43) | ACHETSHRALDH1A1KDM4EGAA | |
| SCHEMBL4961160 | 0.74 | ALDH1A1 (0.48) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL11546467 | 0.71 | MEN1 (0.42) | TSHRALDH1A1KDM4EHSD17B10TP53 | |
| SCHEMBL24662703 | 0.70 | ALDH1A1 (0.43) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL17177077 | 0.69 | KDM4E (0.49) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL1794501 | 0.69 | MAOA (0.63) | ALDH1A1KDM4EGAAHSD17B10HPGD | |
| SCHEMBL16019294 | 0.68 | CYP2C19 (0.39) | ALDH1A1KDM4EGAAHSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0770085-A1 | HETEROAROMATIC DIPHOSPHINES AS CHIRAL LIGANDS | ITALFARMACO SUD S.p.A. (IT) | 1997-05-02 | — | — | EP | disclosed |