Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.50 |
| ▸ | HTR3A | P46098 | 4/20 | 0.50 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 2/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.38 |
| ▸ | SELE | P16581 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL576094 | 0.97 | ACHE (0.53) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL15906499 | 0.94 | HTR1A (0.50) | HTR1AHTR3AACHEHAO1TSHR | |
| Phosphine SCHEMBL29157942 | 0.94 | HTR1A (0.50) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL29031117 | 0.94 | HTR1A (0.55) | HTR1AHTR3AACHEHAO1TSHR | |
| Cyanide SCHEMBL8000324 | 0.89 | AR (0.50) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL9488937 | 0.85 | HTR1A (0.53) | HTR1AHTR3AACHEHAO1TSHR | |
| Bicarbonate SCHEMBL31082134 | 0.85 | L3MBTL1 (0.45) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL9488226 | 0.83 | HAO1 (0.47) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL17301730 | 0.83 | L3MBTL1 (0.47) | HTR1AHTR3AACHEHAO1TSHR | |
| SCHEMBL3859717 | 0.83 | CYP3A4 (0.52) | HTR1AHTR3AHAO1ARALDH1A1 |
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-104220466-B | For the method preparing polydiene | 株式会社普利司通 | 2016-09-21 | — | — | CN | disclosed |
| US-4082808-A | ANTIOXIDANTS, INTERMEDIATES FOR POLYESTERS, POLYCARBONATES, EPOXY RESINS | GENERAL ELECTRIC COMPANY (US) | 1978-04-04 | — | — | US | disclosed |
| US-3953519-A | BASES, EPOXY COMPOUNDS, OLEFINS | GENERAL ELECTRIC COMPANY (US) | 1976-04-27 | — | — | US | disclosed |