Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | KIF11 | P52732 | 2/20 | 0.39 |
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29225750 | 1.00 | ALDH1A1 (0.55) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| SCHEMBL4208264 | 0.92 | ADRB2 (0.59) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| SCHEMBL3555995 | 0.92 | ADRB2 (0.59) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| SCHEMBL342044 | 0.92 | ADRB2 (0.59) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| Hydrochloric Acid SCHEMBL6795220 | 0.90 | ADRB2 (0.56) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| Hydrochloric Acid SCHEMBL3175939 | 0.90 | ADRB2 (0.56) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| Hydrochloric Acid SCHEMBL6801092 | 0.90 | ADRB2 (0.56) | ALDH1A1TP53CYP3A4TDP1ADRB2 | |
| SCHEMBL256589 | 0.84 | ALDH1A1 (0.61) | ALDH1A1TP53CYP3A4TDP1HSD17B10 | |
| SCHEMBL6659986 | 0.82 | ALDH1A1 (0.58) | ALDH1A1TP53CYP3A4TDP1HSD17B10 | |
| SCHEMBL20121519 | 0.82 | ADRB2 (0.41) | ALDH1A1TP53CYP3A4TDP1ADRB2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118108676-A | Benzenesulfonamide compound, pharmaceutical composition and application thereof | 中国药科大学 | 2024-05-31 | — | — | CN | disclosed |