Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.46 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.46 |
| ▸ | TYMS | P04818 | 2/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 2/20 | 0.41 |
| ▸ | CCND1 | P24385 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1658503 | 0.82 | ALDH1A1 (0.52) | ALOX5POLBTYMSPARP1ALDH1A1 | |
| SCHEMBL3472277 | 0.77 | KDM4E (0.55) | POLBTYMSPARP1ALDH1A1HSD17B10 | |
| SCHEMBL2325768 | 0.73 | PARP1 (0.47) | POLBTYMSPARP1ALDH1A1HSD17B10 | |
| SCHEMBL492860 | 0.72 | CDK4 (0.53) | POLBTYMSALDH1A1HSD17B10TDP1 | |
| SCHEMBL29363212 | 0.72 | CDK4 (0.53) | POLBTYMSALDH1A1HSD17B10TDP1 | |
| SCHEMBL30032319 | 0.72 | CDK4 (0.53) | POLBTYMSALDH1A1HSD17B10TDP1 | |
| SCHEMBL7485156 | 0.71 | F2 (0.58) | POLBTYMSALDH1A1HSD17B10TDP1 | |
| SCHEMBL31454054 | 0.69 | DAO (0.52) | ALOX5POLBTYMSPARP1ALDH1A1 | |
| SCHEMBL2565892 | 0.69 | PARP1 (0.55) | POLBTYMSPARP1ALDH1A1HSD17B10 | |
| SCHEMBL460847 | 0.69 | KDM4E (0.57) | TYMSPARP1ALDH1A1HSD17B10TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022229234-A1 | NITROGENOUS HETEROCYCLIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-11-03 | — | — | WO | disclosed |