Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | ALPG | P10696 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29923677 | 0.71 | ALDH1A1 (0.38) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL21130264 | 0.71 | ALDH1A1 (0.37) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL1225897 | 0.69 | ERN1 (0.39) | ALDH1A1KDM4ELMNAGAAERN1 | |
| SCHEMBL13884499 | 0.66 | TSHR (0.53) | ALDH1A1KDM4EMAPTCYP3A4ALOX15 | |
| SCHEMBL1225993 | 0.64 | KMT2A (0.41) | ALDH1A1KDM4EMAPTERN1CA1 | |
| SCHEMBL3661234 | 0.63 | ALDH1A1 (0.48) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL19248985 | 0.62 | ALDH1A1 (0.41) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL12581613 | 0.62 | CYP3A4 (0.42) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL6905386 | 0.61 | NOS3 (0.38) | ALDH1A1KDM4ELMNAGAAMAPT | |
| SCHEMBL1929437 | 0.61 | ERN1 (0.44) | ALDH1A1KDM4EMAPTERN1CA1 |
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-3889154-A1 | HETEROCYCLIC COMPOUND INTERMEDIATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Wuhan LL Science And Technology Development Co., Ltd. (CN) | 2021-10-06 | — | — | EP | disclosed |