Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL2214200 | 0.86 | ALDH1A1 (0.42) | CA12CA1CA9KDM4EMAPK1 | |
| SCHEMBL1389283 | 0.82 | TLR8 (0.37) | CA12CA1CA9KDM4EMAPK1 | |
| SCHEMBL2214684 | 0.81 | TSHR (0.39) | KDM4EMAPK1TDP1 | |
| SCHEMBL2256189 | 0.81 | L3MBTL1 (0.41) | KDM4ETDP1 | |
| SCHEMBL1396371 | 0.79 | LTA4H (0.41) | MAPK1TDP1 | |
| SCHEMBL292920 | 0.78 | TLR8 (0.41) | KDM4EMAPK1TDP1 | |
| SCHEMBL2458064 | 0.78 | MCHR1 (0.41) | MAPK1TDP1 | |
| SCHEMBL6283599 | 0.78 | MCHR1 (0.41) | MAPK1TDP1 | |
| SCHEMBL2456698 | 0.78 | MCHR1 (0.41) | MAPK1TDP1 | |
| SCHEMBL6538521 | 0.78 | KCNA3 (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1919907-A2 | HETEROCYCLIC COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026959-A2 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-03-08 | — | — | WO | disclosed |