Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | TACR2 | P21452 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7691731 | 0.86 | ESR1 (0.43) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL27310345 | 0.85 | ESR1 (0.42) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL27321576 | 0.85 | ESR1 (0.42) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL981992 | 0.84 | ESR1 (0.40) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL225807 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL2962583 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL2971186 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL151724 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL1610040 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL3673116 | 0.82 | PTGS2 (0.57) | ESR1ADRA2AADORA3TACR2SLC6A2 |
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-109790176-B | Organic semiconductor compound | 天光材料科技股份有限公司 | 2023-06-02 | — | — | CN | disclosed |
| CN-107915661-A | Organic semiconductor compound | 默克专利股份有限公司 | 2018-04-17 | — | — | CN | disclosed |