Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.35 |
| ▸ | PDE5A | O76074 | 3/20 | 0.34 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24526756 | 1.00 | TACR1 (0.35) | TACR1PDE5AP2RY14HDAC1HDAC6 | |
| SCHEMBL24527025 | 0.89 | UCHL1 (0.38) | TACR1HDAC1HDAC6HDAC5RIPK1 | |
| SCHEMBL24527120 | 0.84 | MMP9 (0.37) | ROCK2 | |
| SCHEMBL12477897 | 0.83 | AR (0.36) | TACR1RIPK1NR1H2NR1H3 | |
| SCHEMBL456786 | 0.83 | AR (0.36) | TACR1RIPK1NR1H2NR1H3 | |
| SCHEMBL24526992 | 0.82 | MMP9 (0.33) | TACR1JAK2NTRK1ROCK2 | |
| SCHEMBL451781 | 0.82 | RIPK1 (0.50) | TACR1PDE5ARIPK1JAK2NTRK1 | |
| SCHEMBL21723215 | 0.82 | RIPK1 (0.50) | TACR1PDE5ARIPK1JAK2NTRK1 | |
| SCHEMBL29744544 | 0.82 | RIPK1 (0.50) | TACR1PDE5ARIPK1JAK2NTRK1 | |
| SCHEMBL430829 | 0.82 | RIPK1 (0.50) | TACR1PDE5ARIPK1JAK2NTRK1 |
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-2022129047-A2 | NOVEL MODULATORS OF THE NMDA RECEPTOR | H. LUNDBECK A/S (DK) | 2022-06-23 | — | — | WO | disclosed |