Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31645304 | 0.90 | CYP3A4 (0.42) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL31644838 | 0.82 | CYP3A4 (0.51) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL31644782 | 0.81 | CYP3A4 (0.35) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL31644815 | 0.74 | CYP3A4 (0.53) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL31260325 | 0.73 | TSHR (0.50) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL22980400 | 0.72 | CYP3A4 (0.49) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL16387388 | 0.72 | CYP3A4 (0.51) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL31260413 | 0.72 | TSHR (0.48) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL21111957 | 0.71 | TSHR (0.50) | TSHRCYP3A4TDP1ATMALDH1A1 | |
| SCHEMBL21383708 | 0.71 | CYP3A4 (0.49) | TSHRCYP3A4TDP1ATMALDH1A1 |
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-2025132542-A1 | MACROCYCLIC OREXIN AGONISTS | IDORSIA PHARMACEUTICALS LTD (CH) | 2025-06-26 | — | — | WO | disclosed |