Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | HTR6 | P50406 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 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 | |
|---|---|---|---|---|
| SCHEMBL8893112 | 0.79 | KMT2A (0.52) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL8892369 | 0.75 | RECQL (0.45) | CYP2C9LMNACA12CA1CA2 | |
| SCHEMBL31028744 | 0.74 | CA2 (0.51) | CYP3A4CA12CA1CA2CA9 | |
| SCHEMBL15689634 | 0.71 | HTR6 (0.59) | TSHRHTR6CYP2C9LMNAMPO | |
| SCHEMBL25230363 | 0.70 | CA12 (0.40) | CYP3A4CA12CA1CA2CA9 | |
| Dapsone SCHEMBL5055312 | 0.70 | HTR6 (1.00) | TSHRHTR6CYP2C9LMNAMPO | |
| Dapsone SCHEMBL21428 | 0.70 | HTR6 (1.00) | TSHRHTR6CYP2C9LMNAMPO | |
| SCHEMBL324893 | 0.70 | HTR6 (1.00) | TSHRHTR6CYP2C9LMNAMPO | |
| Dapsone SCHEMBL1219599 | 0.70 | HTR6 (1.00) | TSHRHTR6CYP2C9LMNAMPO | |
| SCHEMBL10596934 | 0.70 | HTR6 (1.00) | TSHRHTR6CYP2C9LMNAMPO |
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-1997024340-A1 | OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-07-10 | — | — | WO | disclosed |