Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11425470 | 0.81 | CA12 (0.50) | CA12CA2CA7CA9CA14 | |
| SCHEMBL29771091 | 0.78 | HRH3 (0.48) | CA12CA2CA7CA9CA14 | |
| SCHEMBL6647188 | 0.75 | KDM4E (0.45) | CA12CA2CA7CA9CA14 | |
| SCHEMBL29387070 | 0.74 | TSHR (0.69) | CA12CA2CA7CA9CA14 | |
| SCHEMBL180024 | 0.74 | TSHR (0.69) | CA12CA2CA7CA9CA14 | |
| SCHEMBL28679275 | 0.73 | TSHR (0.49) | CA12CA2CA7CA9CA14 | |
| Ammonia Solution, Strong SCHEMBL10715942 | 0.73 | TSHR (0.67) | TSHRMEN1KMT2AALDH1A1HSD17B10 | |
| SCHEMBL21808822 | 0.71 | LMNA (0.49) | CA12CA2CA7CA9CA14 | |
| SCHEMBL1200735 | 0.71 | ALDH1A1 (0.46) | TSHRRAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL9505270 | 0.71 | TSHR (0.68) | CA12CA2CA7CA9CA14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118201915-A | Pyridazinylamino derivatives as ALK5 inhibitors | 奇斯药制品公司 | 2024-06-14 | — | — | CN | disclosed |