Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 11/20 | 0.69 |
| ▸ | CA2 | P00918 | 11/20 | 0.69 |
| ▸ | CA12 | O43570 | 9/20 | 0.69 |
| ▸ | CA9 | Q16790 | 9/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | PKM | P14618 | 1/20 | 0.64 |
| ▸ | PDE5A | O76074 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
| ▸ | GRK2 | P25098 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL10431528 | 0.84 | CA12 (0.51) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL25920674 | 0.84 | CA12 (0.51) | CA1CA2CA12CA9ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL10582019 | 0.83 | CA12 (0.50) | CA1CA2CA12CA9ALDH1A1 | |
| Benzylsulfamide SCHEMBL49548 | 0.81 | CA2 (1.00) | CA1CA2CA12CA9ALDH1A1 | |
| Benzylsulfamide SCHEMBL3648127 | 0.80 | CA1 (0.97) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL14372405 | 0.79 | RXFP1 (0.64) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL6690772 | 0.78 | HTT (0.57) | KMT2A | |
| SCHEMBL3988768 | 0.78 | CA2 (0.63) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL11861559 | 0.78 | CA2 (0.60) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL13654266 | 0.77 | CA2 (0.61) | CA1CA2CA12CA9MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-111518053-B | 4-benzyl amino benzene sulfonamide derivative, preparation and application thereof | 武汉赛莱亚生物科技有限公司 | 2023-03-14 | — | — | CN | disclosed |
| WO-2003101381-A2 | 1,2 DIAMIDO CYCLOALKYL SODIUM CHANNEL BLOCKERS | MERCK & CO., INC. (US) | 2003-12-11 | — | — | WO | disclosed |