Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL17136141 | 0.85 | ALDH1A1 (0.38) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| Cyanate SCHEMBL28170473 | 0.72 | CA1 (0.35) | ALDH1A1TSHR | |
| SCHEMBL1103925 | 0.71 | — | — | |
| SCHEMBL9536619 | 0.71 | ALDH1A1 (0.35) | ALDH1A1TP53HPGDTSHRMAPK1 | |
| Water SCHEMBL27597326 | 0.71 | TSHR (0.39) | ALDH1A1TSHRTDP1 | |
| Water SCHEMBL1898758 | 0.71 | TSHR (0.39) | ALDH1A1TSHRTDP1 | |
| Water SCHEMBL28432640 | 0.71 | TSHR (0.39) | ALDH1A1TSHRTDP1 | |
| Water SCHEMBL26643053 | 0.71 | TSHR (0.39) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11956971 | 0.70 | — | — | |
| Cyanate SCHEMBL28272967 | 0.70 | CA1 (0.33) | ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5155108-A | Imidazopyridazines and use as antiasthmatic agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-10-13 | — | — | US | disclosed |
| EP-0440119-A1 | Imidazopyridazine compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-08-07 | — | — | EP | disclosed |