Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.42 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 2/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | CTSE | P14091 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | ABL2 | P42684 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.38 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.38 |
| ▸ | PBRM1 | Q86U86 | 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 | |
|---|---|---|---|---|
| SCHEMBL23123370 | 1.00 | SCN9A (0.43) | SCN9AGPR119USP30KDM1AHDAC1 | |
| SCHEMBL29795605 | 1.00 | SCN9A (0.43) | SCN9AGPR119USP30KDM1AHDAC1 | |
| SCHEMBL29745148 | 0.84 | GPR119 (0.41) | SCN9AGPR119USP30HDAC1EGFR | |
| SCHEMBL23122914 | 0.84 | GPR119 (0.41) | SCN9AGPR119USP30HDAC1EGFR | |
| SCHEMBL29795670 | 0.81 | HDAC1 (0.46) | GPR119USP30KDM1AHDAC1NAMPT | |
| SCHEMBL23124336 | 0.81 | HDAC1 (0.46) | GPR119USP30KDM1AHDAC1NAMPT | |
| SCHEMBL31152780 | 0.78 | SMARCA2 (0.55) | GPR119NAMPTBACE1SMARCA2SMARCA4 | |
| SCHEMBL1249642 | 0.78 | SMARCA2 (0.55) | GPR119NAMPTBACE1SMARCA2SMARCA4 | |
| SCHEMBL30796382 | 0.78 | USP30 (0.49) | SCN9AGPR119USP30EGFRSRC | |
| SCHEMBL20156957 | 0.77 | GPR119 (0.47) | SCN9AGPR119USP30NAMPTRORC |
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 |
|---|---|---|---|---|---|---|---|
| EP-4031532-A1 | SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS | Bial-R&D Investments, S.A. (PT) | 2022-07-27 | — | — | EP | disclosed |