Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 9/20 | 0.45 |
| ▸ | ACHE | P22303 | 7/20 | 0.45 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7185283 | 0.95 | ABCG2 (0.51) | ABCG2BCHEACHEDPP4MAOA | |
| SCHEMBL7182883 | 0.91 | ABCG2 (0.53) | ABCG2MAOAMAOBLMNAMAPT | |
| SCHEMBL7182878 | 0.91 | ABCG2 (0.53) | ABCG2MAOAMAOBLMNAMAPT | |
| SCHEMBL7189071 | 0.87 | ABCG2 (0.46) | ABCG2CYP1A1CYP1B1BCHEACHE | |
| SCHEMBL7177775 | 0.85 | ABCG2 (0.51) | ABCG2CYP1A1CYP1B1BCHEACHE | |
| SCHEMBL7806439 | 0.84 | ABCG2 (0.74) | ABCG2CYP1A1CYP1B1BCHEMAOA | |
| SCHEMBL7806442 | 0.84 | ABCG2 (0.74) | ABCG2CYP1A1CYP1B1BCHEMAOA | |
| SCHEMBL7186923 | 0.84 | ABCG2 (0.43) | ABCG2CYP1A1CYP1B1BCHEACHE | |
| SCHEMBL7179229 | 0.84 | ABCG2 (0.52) | ABCG2CYP1A1CYP1B1BCHEACHE | |
| SCHEMBL7184578 | 0.83 | ABCG2 (0.43) | ABCG2CYP1A1CYP1B1BCHEACHE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6603046-B1 | The invention is drawn to novel bis-aromatic a, beta -unsaturated ketones. The compounds are useful in the treatment and prophylaxis of diseases caused by parasites or bacteria. | LICA PHARMACEUTICALS A/S (DK) | 2003-08-05 | — | — | US | disclosed |
| EP-0634927-B1 | TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA | LICA PHARMACEUTICALS AS (DK) | 2001-07-04 | — | — | EP | disclosed |
| US-5985935-A | PARASITICIDES OR BACTERICIDES | STATENS SERUMINSTITUT (DK) | 1999-11-16 | — | — | US | disclosed |
| EP-0634927-A1 | TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA | STATENS SERUMINSTITUT (DK) | 1995-01-25 | — | — | EP | disclosed |
| WO-1993017671-A1 | TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA | STATENS SERUMINSTITUT (DK) | 1993-09-16 | — | — | WO | disclosed |