Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5276540 | 0.94 | HCAR2 (0.40) | HCAR2HCAR3 | |
| SCHEMBL17950108 | 0.79 | KDM4E (0.37) | — | |
| SCHEMBL460418 | 0.79 | MEN1 (0.41) | HCAR2MAPTALDH1A1PKMHPGD | |
| Hydrochloric Acid SCHEMBL17941984 | 0.78 | KDM4E (0.36) | TLR8 | |
| SCHEMBL19501783 | 0.78 | HCAR2 (0.38) | HCAR2MAPTALDH1A1PKMHPGD | |
| SCHEMBL11318964 | 0.78 | MEN1 (0.40) | HCAR2MAPTALDH1A1PKMHPGD | |
| SCHEMBL28089660 | 0.78 | ALDH1A1 (0.39) | HCAR2MAPTALDH1A1PKMHPGD | |
| SCHEMBL5603217 | 0.78 | MEN1 (0.40) | HCAR2MAPTALDH1A1PKMHPGD | |
| SCHEMBL7855161 | 0.78 | HCAR2 (0.35) | HCAR2MAPTALDH1A1PKMHPGD | |
| SCHEMBL21573787 | 0.76 | KDM4E (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5100890-A | Antidepressants, Fungicides | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-03-31 | — | — | US | disclosed |
| US-5023357-A | Arylmethylazole preparation processes | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-06-11 | — | — | US | disclosed |
| US-4876354-A | FUNGICIDES, ANTIDEPRESSANTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-10-24 | — | — | US | disclosed |