Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LIPE | Q05469 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7374539 | 1.00 | CYP2A13 (0.60) | CYP2A13KDM4EALDH1A1POLBMPO | |
| SCHEMBL21352377 | 0.84 | ALDH1A1 (0.55) | CYP2A13KDM4EALDH1A1POLBMPO | |
| SCHEMBL29504703 | 0.84 | ALDH1A1 (0.55) | CYP2A13KDM4EALDH1A1POLBMPO | |
| SCHEMBL28983737 | 0.84 | KDM4E (0.53) | CYP2A13KDM4EALDH1A1POLBMPO | |
| SCHEMBL29952724 | 0.82 | ALDH1A1 (0.58) | KDM4EALDH1A1POLBMPOMEN1 | |
| Hydrochloric Acid SCHEMBL29954918 | 0.82 | ALDH1A1 (0.53) | KDM4EALDH1A1POLBMPOMEN1 | |
| SCHEMBL2464403 | 0.82 | ALDH1A1 (0.58) | KDM4EALDH1A1POLBMPOMEN1 | |
| SCHEMBL2553323 | 0.81 | MC4R (0.55) | KDM4EALDH1A1POLBMPOKMT2A | |
| Hydrochloric Acid SCHEMBL29951165 | 0.81 | ALDH1A1 (0.56) | KDM4EALDH1A1POLBMPOMEN1 | |
| Hydrochloric Acid SCHEMBL29956387 | 0.81 | ALDH1A1 (0.56) | KDM4EALDH1A1POLBMPOMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |