Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | SLC26A6 | Q9BXS9 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL577793 | 0.85 | ALDH1A1 (0.52) | CYP1A2POLBCA12CA1CA2 | |
| SCHEMBL15058379 | 0.81 | TSHR (0.44) | CYP1A2CA9MEN1RAB9AKMT2A | |
| SCHEMBL352579 | 0.80 | CYP1A2 (0.54) | CYP1A2POLBCA12CA1CA2 | |
| SCHEMBL9461048 | 0.79 | ALDH1A1 (0.53) | CYP1A2POLBCA12CA1CA2 | |
| SCHEMBL4253373 | 0.76 | POLB (0.49) | POLBCA12CA1CA2CA7 | |
| SCHEMBL9460504 | 0.76 | CYP1A2 (0.49) | CYP1A2POLBMEN1RAB9AKMT2A | |
| SCHEMBL19330218 | 0.76 | CA12 (0.54) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL19330146 | 0.76 | CA12 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL30701145 | 0.76 | CA12 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15615316 | 0.76 | KMT2A (0.48) | CYP1A2CA12CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5053072-A | HETEROCYCLIC N-ACYLSULFONAMIDES, AND THEIR USE AS HERBICIDES OR GROWTH REGULATORS | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-01 | — | — | US | disclosed |