Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.48 |
| ▸ | KRAS | P01116 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL7185139 | 0.87 | LMNA (0.47) | CYP1A1CYP1B1 | |
| SCHEMBL7184621 | 0.87 | CYP1A1 (0.41) | CA1CA2ABCG2CYP1A1CYP1B1 | |
| SCHEMBL7187235 | 0.85 | DPP4 (0.42) | ABCG2CYP1A1CYP1B1 | |
| SCHEMBL7190651 | 0.81 | ABCG2 (0.61) | CA1CA2ABCG2CAPN1TNFRSF1A | |
| SCHEMBL7178660 | 0.79 | ABCG2 (0.66) | ABCG2CYP1A1CYP1B1CAPN1TNFRSF1A | |
| SCHEMBL7178662 | 0.79 | ABCG2 (0.66) | ABCG2CYP1A1CYP1B1CAPN1TNFRSF1A | |
| SCHEMBL7179752 | 0.78 | ABCG2 (0.60) | ABCG2KRASCAPN1TNFRSF1ACTSL | |
| SCHEMBL7179754 | 0.78 | ABCG2 (0.60) | ABCG2KRASCAPN1TNFRSF1ACTSL | |
| SCHEMBL7177307 | 0.77 | ABCG2 (0.45) | ABCG2KRASCAPN1GABRA3GABRA2 | |
| SCHEMBL7190670 | 0.77 | ALDH1A1 (0.43) | CA1CA2ABCG2KRASCAPN1 |
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 3 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 |