Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | DRD4 | P21917 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 |
| ▸ | TDP2 | O95551 | 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 | |
|---|---|---|---|---|
| SCHEMBL25720243 | 0.91 | DRD2 (0.40) | HSP90AA1METAP1DRD2DRD4CYP1A2 | |
| SCHEMBL25720347 | 0.79 | TSHR (0.37) | DRD2CYP1A2 | |
| SCHEMBL28863723 | 0.78 | METAP1 (0.43) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL24329683 | 0.78 | HSP90AA1 (0.55) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL23253870 | 0.76 | METAP1 (0.39) | METAP1PGRACHE | |
| SCHEMBL25929517 | 0.76 | METAP1 (0.41) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL24726895 | 0.76 | HSP90AA1 (0.44) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL31497079 | 0.73 | HSP90AA1 (0.46) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL23862771 | 0.72 | KCNH2 (0.41) | HSP90AA1METAP1CA1CA2CA4 | |
| SCHEMBL29572171 | 0.71 | METAP1 (0.57) | HSP90AA1METAP1CA1CA2CA4 |
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-4190779-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE | LT Materials Co., Ltd. (KR) | 2023-06-07 | — | — | EP | disclosed |