Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 5/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | DPP4 | P27487 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080373 | 1.00 | ABCG2 (0.65) | ABCG2TDP1SMN1; SMN2NFKB1DPP4 | |
| SCHEMBL11282170 | 0.84 | ABCG2 (0.75) | ABCG2TDP1NFKB1DPP4NFKB2 | |
| SCHEMBL11282177 | 0.84 | ABCG2 (0.75) | ABCG2TDP1NFKB1DPP4NFKB2 | |
| 4,2',4',6'-Tetramethoxychalcone SCHEMBL633215 | 0.83 | ABCG2 (0.94) | ABCG2TDP1NFKB1DPP4NFKB2 | |
| 4,2',4',6'-Tetramethoxychalcone SCHEMBL633892 | 0.83 | ABCG2 (0.94) | ABCG2TDP1NFKB1DPP4NFKB2 | |
| SCHEMBL11075157 | 0.83 | ABCG2 (0.70) | ABCG2TDP1SMN1; SMN2NFKB1DPP4 | |
| SCHEMBL11075164 | 0.83 | ABCG2 (0.70) | ABCG2TDP1SMN1; SMN2NFKB1DPP4 | |
| SCHEMBL11078315 | 0.82 | ABCG2 (0.71) | ABCG2TDP1SMN1; SMN2NFKB1DPP4 | |
| SCHEMBL11078312 | 0.82 | ABCG2 (0.71) | ABCG2TDP1SMN1; SMN2NFKB1DPP4 | |
| SCHEMBL10846921 | 0.81 | ABCG2 (0.79) | ABCG2TDP1NFKB1DPP4NFKB2 |
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-0021000-B1 | SUBSTITUTED ACETOPHENONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-02-22 | — | — | EP | claimed |
| US-4327088-A | ANTIVIRAL AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1982-04-27 | — | — | US | disclosed |