Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1660912 | 1.00 | ADRB2 (0.43) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL2487204 | 0.91 | ADRB2 (0.52) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL29588862 | 0.91 | ADRB2 (0.52) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL5153891 | 0.80 | ADRB2 (0.37) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL16593838 | 0.76 | PTK2 (0.39) | ABCB1PREP | |
| SCHEMBL430401 | 0.75 | ADRB2 (0.53) | ADRB2ADRB1HTR1A | |
| SCHEMBL165220 | 0.75 | KDM4E (0.61) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL29506042 | 0.75 | KDM4E (0.61) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL7096400 | 0.73 | HPGD (0.38) | ADRB2ADRB1HTR1AADRB3TSHR | |
| SCHEMBL7096401 | 0.73 | HPGD (0.38) | ADRB2ADRB1HTR1AADRB3TSHR |
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-110785413-B | Pyrimidinoxybenzo-fused compounds as herbicides | FMC公司 | 2024-08-02 | — | — | CN | disclosed |
| CN-117642392-A | Preparation and application of compounds with immunoregulation function | 上海轶诺药业有限公司 | 2024-03-01 | — | — | CN | disclosed |
| CN-115433210-A | Preparation and application of compound with immunoregulation function | 上海轶诺药业有限公司 | 2022-12-06 | — | — | CN | disclosed |