Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 5/20 | 0.41 |
| ▸ | CA1 | P00915 | 5/20 | 0.41 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA7 | P43166 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28021311 | 0.81 | HSP90AB1 (0.57) | HSP90AB1POLBHTTCA12CA1 | |
| SCHEMBL27731721 | 0.81 | ALDH1A1 (0.58) | HSP90AB1POLBALDH1A1TSHRRECQL | |
| SCHEMBL27731857 | 0.81 | HSP90AB1 (0.43) | HSP90AB1POLBALDH1A1MEN1KMT2A | |
| SCHEMBL27731731 | 0.81 | HSP90AB1 (0.43) | HSP90AB1POLBHTTALDH1A1MEN1 | |
| SCHEMBL14215826 | 0.79 | CA12 (0.44) | HSP90AB1CA12CA1CA2CA7 | |
| SCHEMBL8505369 | 0.79 | CA12 (0.55) | POLBHTTCA12CA1CA2 | |
| SCHEMBL13223473 | 0.78 | ALDH1A1 (0.51) | HSP90AB1CA12CA1CA2CA7 | |
| SCHEMBL481085 | 0.77 | HSP90AB1 (1.00) | HSP90AB1POLBHTTCA12CA1 | |
| SCHEMBL29457585 | 0.77 | HSP90AB1 (1.00) | HSP90AB1POLBHTTCA12CA1 | |
| SCHEMBL4706474 | 0.77 | HSP90AB1 (1.00) | HSP90AB1POLBHTTCA12CA1 |
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-113683522-A | Preparation method of N-methyltyramine hydrochloride | 广汉市派瑞林科技有限责任公司 | 2021-11-23 | — | — | CN | disclosed |
| CN-102381989-A | Chemical synthetic method for synephrine hydrochloride | SUZHOU HONGRUI MEDICAL TECHNOLOGY CO LTD | 2012-03-21 | — | — | CN | disclosed |
| EP-0381033-B1 | Carboxylic-acid and sulphonic-acid amides | HOFFMANN LA ROCHE (CH) | 1994-03-23 | — | — | EP | disclosed |