Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | DRD3 | P35462 | 3/20 | 0.47 |
| ▸ | PLAU | P00749 | 1/20 | 0.47 |
| ▸ | ANPEP | P15144 | 1/20 | 0.47 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28095840 | 0.88 | PLAU (0.47) | DRD2DRD3PLAUANPEPHPRT1 | |
| Isoquinoline SCHEMBL27294345 | 0.86 | DRD2 (0.37) | DRD2DRD3PLAUANPEPHTR1A | |
| Beta-Naphtoic Acid SCHEMBL27806332 | 0.84 | SIRT2 (0.39) | DRD2DRD3ANPEPHTR6 | |
| SCHEMBL27497738 | 0.81 | HPRT1 (0.44) | ANPEPHPRT1HTR1AHTR7 | |
| SCHEMBL27301903 | 0.81 | HPRT1 (0.44) | ANPEPHPRT1HTR1AHTR7 | |
| SCHEMBL27574172 | 0.81 | HTR7 (0.45) | ANPEPHPRT1HTR1AHTR7 | |
| SCHEMBL28081883 | 0.81 | HPRT1 (0.44) | ANPEPHPRT1HTR1AHTR7 | |
| SCHEMBL28063838 | 0.81 | ANPEP (0.40) | ANPEPHPRT1HTR1AHTR7 | |
| SCHEMBL28063782 | 0.81 | ANPEP (0.40) | ANPEPHPRT1HTR1AHTR7 | |
| Fluoride SCHEMBL27587185 | 0.80 | HTR7 (0.44) | ANPEPHPRT1HTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106946748-A | Deliver method, compound, composition and the carrier of the propane sulfonic acid of 3 amino 1 | BHI有限合资公司 | 2017-07-14 | — | — | CN | disclosed |
| CN-103787927-B | Deliver method, compound, compositionss and the carrier of 3 amino 1 propane sulfonic acid | BHI有限合资公司 | 2017-03-01 | — | — | CN | disclosed |
| CN-104693205-B | Total synthesis method of amides alkaloid | 西安交通大学 | 2017-02-01 | — | — | CN | disclosed |