Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 6/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | MAOB | P27338 | 5/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Aniline SCHEMBL28483950 | 0.95 | TSHR (0.55) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL28484193 | 0.91 | TSHR (0.50) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL28119117 | 0.81 | TSHR (0.73) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL9007751 | 0.78 | TSHR (0.92) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL1702729 | 0.78 | — | — | |
| Biphenyl SCHEMBL63645 | 0.76 | ALDH1A1 (0.53) | TSHRTDP1CYP3A4TAAR1HSD17B10 | |
| Aniline SCHEMBL27926640 | 0.75 | TSHR (0.73) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL825918 | 0.75 | TSHR (0.55) | TSHRMAOATDP1CYP3A4TAAR1 | |
| Aniline SCHEMBL11818606 | 0.74 | — | — | |
| Aniline SCHEMBL1984004 | 0.74 | — | — |
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-106459362-B | Silylated polyurethanes | 亨茨曼国际有限公司 | 2020-10-13 | — | — | CN | claimed |
| CN-106459362-B | Silylated polyurethanes | 亨茨曼国际有限公司 | 2020-10-13 | — | — | CN | disclosed |