Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | HTR5A | P47898 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | CMA1 | P23946 | 2/20 | 0.38 |
| ▸ | AHR | P35869 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2061242 | 0.82 | CA9 (0.58) | BRD4CREBBPMEN1KMT2ACMA1 | |
| SCHEMBL25249364 | 0.82 | CMA1 (0.60) | BRD4CREBBPHSD17B10AKR1B1MEN1 | |
| SCHEMBL26228613 | 0.81 | PARP1 (0.50) | EPHX2BRD4CREBBPHSD17B10PKM | |
| SCHEMBL26225761 | 0.80 | HPGD (0.41) | BRD4CREBBPHSD17B10MEN1KMT2A | |
| SCHEMBL13090753 | 0.79 | BRD4 (0.61) | MMP12HTR5ABRD4CREBBPAKR1B1 | |
| SCHEMBL25223953 | 0.78 | MAOB (0.35) | BRD4CREBBPMEN1KMT2ACMA1 | |
| SCHEMBL2945674 | 0.77 | BRD4 (0.62) | EPHX2BRD4CREBBPKMT2AAHR | |
| SCHEMBL2061201 | 0.77 | TDP2 (0.47) | AKR1B1MEN1KMT2AMAPTRAB9A | |
| SCHEMBL278958 | 0.77 | AHR (0.61) | MMP12EPHX2HTR5ABRD4CREBBP | |
| SCHEMBL1025832 | 0.75 | CA9 (0.62) | MMP12EPHX2HTR5ABRD4CREBBP |
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-2023154282-A1 | COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS | THERAS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |