Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | L3MBTL3 | Q96JM7 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.35 |
| ▸ | ACACA | Q13085 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31482230 | 0.84 | GRM1 (0.33) | ALDH1A1ADRA1AHRH3HSD17B10CYP3A4 | |
| SCHEMBL31482209 | 0.82 | ADRA1A (0.41) | ALDH1A1ADRA1AL3MBTL3L3MBTL1ACACB | |
| SCHEMBL31482143 | 0.81 | KMT2A (0.45) | ALDH1A1ADRA1AMAPK1L3MBTL3L3MBTL1 | |
| SCHEMBL31482260 | 0.81 | ADRA1A (0.46) | ALDH1A1ADRA1AKMT2A | |
| SCHEMBL31482259 | 0.81 | ADRA1A (0.46) | ALDH1A1ADRA1AKMT2A | |
| SCHEMBL31482170 | 0.80 | ADRA2C (0.43) | ALDH1A1ADRA1AL3MBTL3L3MBTL1KMT2A | |
| SCHEMBL31482174 | 0.79 | ADRA1A (0.40) | ALDH1A1ADRA1AL3MBTL3L3MBTL1KMT2A | |
| SCHEMBL31482083 | 0.79 | ADRA1A (0.43) | ALDH1A1ADRA1AL3MBTL3L3MBTL1KMT2A | |
| SCHEMBL31482107 | 0.69 | MLYCD (0.44) | ALDH1A1KMT2A | |
| SCHEMBL31482153 | 0.68 | KDM4E (0.44) | ALDH1A1HSD17B10HPGDMEN1KMT2A |
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-2025068514-A1 | SUBSTITUTED HETEROCYCLIC CARBOXAMINDES AND USE THEREOF | BAYER AKTIENGESELLSCHAFT (DE) | 2025-04-03 | — | — | WO | disclosed |