Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389305 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL4606706 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL382576 | 0.75 | ALDH1A1 (0.62) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL5966353 | 0.75 | — | — | |
| SCHEMBL1054970 | 0.74 | — | — | |
| SCHEMBL82932 | 0.74 | — | — | |
| SCHEMBL16896971 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL979078 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL16897049 | 0.73 | ALDH1A1 (0.54) | ALDH1A1CA2TDP1CYP3A4TSHR | |
| SCHEMBL19427401 | 0.73 | ALDH1A1 (0.43) | ALDH1A1CA2TDP1CYP3A4TSHR |
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-2009097113-A2 | OXAZOLE AND THIAZOLE COMPOUNDS AS B-CATENIN MODULATORS AND USES THEREOF | NEW YORK UNIVERSITY (US) | 2009-08-06 | — | — | WO | disclosed |