Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31426780 | 0.98 | ALDH1A1 (0.44) | TSHRALDH1A1EPHX2ATMMAPT | |
| SCHEMBL5709969 | 0.93 | TSHR (0.48) | TSHREPHX2MAPTMAPK1NPSR1 | |
| SCHEMBL28869989 | 0.89 | TSHR (0.40) | TSHRALDH1A1ATMNPSR1L3MBTL1 | |
| SCHEMBL31547135 | 0.87 | TSHR (0.38) | TSHRALDH1A1NPSR1L3MBTL1EPHX1 | |
| SCHEMBL13387496 | 0.85 | TSHR (0.43) | TSHRALDH1A1EPHX2ATMMAPT | |
| SCHEMBL16732292 | 0.85 | TSHR (0.43) | TSHRALDH1A1EPHX2ATMMAPT | |
| SCHEMBL11829005 | 0.84 | NAAA (0.48) | TSHRMAPK1NPSR1NAAAEPHX1 | |
| SCHEMBL13518496 | 0.84 | TSHR (0.44) | TSHRALDH1A1EPHX2ATMMAPT | |
| SCHEMBL16732033 | 0.83 | ALDH1A1 (0.42) | TSHRALDH1A1EPHX2ATMMAPT | |
| SCHEMBL6058467 | 0.82 | TSHR (0.52) | TSHRALDH1A1EPHX2ATMNPSR1 |
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-115090283-B | Supported core-shell catalyst, preparation method thereof and application thereof in catalyzing cyclopentyl butyrolactone hydrogenation | 浙江新化化工股份有限公司 | 2024-01-02 | — | — | CN | disclosed |
| CN-115090283-A | Supported core-shell catalyst, preparation method thereof and application thereof in catalyzing hydrogenation of cyclopentyl butyrolactone | 浙江新化化工股份有限公司 | 2022-09-23 | — | — | CN | disclosed |
| EP-0411460-A1 | Perfumery composition comprising 2-cyclohexylpropionic acid or its derivative | KAO CORPORATION (JP) | 1991-02-06 | — | — | EP | disclosed |