Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24732807 | 1.00 | IDO1 (0.42) | IDO1PNMTTAAR1KMT2AMAPK1 | |
| SCHEMBL15654574 | 0.80 | IDO1 (0.41) | IDO1 | |
| SCHEMBL1767780 | 0.79 | IDO1 (0.41) | IDO1PNMTTAAR1 | |
| SCHEMBL13077676 | 0.79 | IDO1 (0.41) | IDO1PNMTTAAR1 | |
| SCHEMBL30822631 | 0.79 | IDO1 (0.41) | IDO1PNMTTAAR1 | |
| SCHEMBL3729703 | 0.79 | PNMT (0.54) | IDO1PNMTTAAR1 | |
| SCHEMBL754847 | 0.79 | IDO1 (0.41) | IDO1PNMTTAAR1 | |
| SCHEMBL8225128 | 0.79 | IDO1 (0.41) | IDO1PNMTKMT2A | |
| SCHEMBL8194043 | 0.78 | IDO1 (0.35) | IDO1 | |
| Hydrochloric Acid SCHEMBL3728173 | 0.77 | PNMT (0.52) | IDO1PNMTTAAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805341-B | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-114805341-A | Aromatic heterocyclic compounds and preparation method and application thereof | 上海翊石医药科技有限公司 | 2022-07-29 | — | — | CN | disclosed |