Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | MC4R | P32245 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13291911 | 1.00 | ACHE (0.58) | ACHEFUCA1HRH4HRH3GRIN2B | |
| SCHEMBL13783796 | 0.88 | FUCA1 (0.60) | ACHEFUCA1GRIN2BSIGMAR1KDM1A | |
| SCHEMBL12372536 | 0.88 | FUCA1 (0.60) | ACHEFUCA1GRIN2BSIGMAR1KDM1A | |
| SCHEMBL1021817 | 0.88 | FUCA1 (0.60) | ACHEFUCA1GRIN2BSIGMAR1KDM1A | |
| Hydrochloric Acid SCHEMBL15751188 | 0.86 | FUCA1 (0.58) | ACHEFUCA1GRIN2BSIGMAR1KDM1A | |
| SCHEMBL4094335 | 0.85 | HRH3 (0.72) | ACHEFUCA1HRH4HRH3SIGMAR1 | |
| SCHEMBL4094332 | 0.85 | HRH3 (0.72) | ACHEFUCA1HRH4HRH3SIGMAR1 | |
| SCHEMBL12050627 | 0.85 | HRH3 (0.72) | ACHEFUCA1HRH4HRH3SIGMAR1 | |
| SCHEMBL4094330 | 0.85 | HRH3 (0.72) | ACHEFUCA1HRH4HRH3SIGMAR1 | |
| SCHEMBL17266469 | 0.85 | HRH3 (0.72) | ACHEFUCA1HRH4HRH3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020248972-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF | JS INNOPHARM (SHANGHAI) LTD (CN) | 2020-12-17 | — | — | WO | disclosed |