Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 9/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30583242 | 1.00 | DRD3 (0.54) | DRD3ACHECA12CA1CA2 | |
| SCHEMBL16335808 | 0.89 | CA12 (0.48) | DRD3ACHECA12CA1CA2 | |
| SCHEMBL2467992 | 0.84 | ACHE (0.51) | DRD3ACHEALOX15 | |
| SCHEMBL803160 | 0.84 | ACHE (0.52) | ACHECA12CA1CA2CA7 | |
| SCHEMBL484845 | 0.84 | ACHE (0.52) | ACHECA12CA1CA2CA7 | |
| SCHEMBL484305 | 0.84 | ACHE (0.52) | ACHECA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL484306 | 0.83 | ACHE (0.54) | ACHECA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL27856384 | 0.83 | ACHE (0.54) | ACHECA12CA1CA2CA7 | |
| Hydrochloric Acid SCHEMBL9315603 | 0.82 | DRD3 (0.48) | DRD3ACHECA12CA1CA2 | |
| SCHEMBL10247494 | 0.81 | ALOX15 (0.47) | DRD3ACHECA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119365479-A | Conjugates comprising Toll-like receptor agonists | 慕宝盛科生物医药(上海)有限公司 | 2025-01-24 | — | — | CN | disclosed |
| EP-2619178-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012038081-A1 | SUBSTITUTED BENZAMIDE COMPOUNDS | Grünenthal GmbH (DE) | 2012-03-29 | — | — | WO | disclosed |