Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.33 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24384111 | 0.80 | PNMT (0.49) | CA1CA2CA4CA6PGR | |
| SCHEMBL28941745 | 0.79 | HSP90AA1 (0.59) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL25720295 | 0.78 | HSP90AA1 (0.38) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL25720243 | 0.72 | DRD2 (0.40) | HSP90AA1METAP1CYP1A2ITGA1CNR1 | |
| SCHEMBL28541741 | 0.72 | HSP90AA1 (0.58) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL9565535 | 0.72 | HSP90AA1 (0.51) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL29572171 | 0.71 | METAP1 (0.57) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL1922789 | 0.71 | METAP1 (0.57) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL1921628 | 0.70 | KDM4E (0.59) | HSP90AA1CA1CA2CA4CA6 | |
| SCHEMBL27565099 | 0.67 | HSP90AA1 (0.46) | HSP90AA1CA1CA2CA4CA6 |
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-3981762-A1 | NITROGEN-CONTAINING COMPOUND, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE | Shaanxi Lighte Optoelectronics Material Co., Ltd. (CN) | 2022-04-13 | — | — | EP | disclosed |