Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 3/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.60 |
| ▸ | CTSL | P07711 | 4/20 | 0.57 |
| ▸ | CTSB | P07858 | 3/20 | 0.57 |
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | P4HB | P07237 | 1/20 | 0.52 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | F3 | P13726 | 1/20 | 0.52 |
| ▸ | XDH | P47989 | 1/20 | 0.52 |
| ▸ | DPP4 | P27487 | 3/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7177251 | 1.00 | CAPN1 (0.60) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7180079 | 0.88 | CAPN1 (0.59) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7180084 | 0.88 | CAPN1 (0.59) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7185747 | 0.82 | ABCG2 (0.88) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7185751 | 0.82 | ABCG2 (0.88) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7182730 | 0.81 | CAPN1 (0.54) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7182732 | 0.81 | CAPN1 (0.54) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7189183 | 0.81 | CTSL (0.64) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL7189177 | 0.81 | CTSL (0.64) | CAPN1ABCG2CTSLCTSBMAOB | |
| SCHEMBL28695326 | 0.79 | CTSL (0.66) | CAPN1ABCG2CTSLCTSBMAOB |
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 |