Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | POLB | P06746 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | STK17B | O94768 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7773706 | 0.91 | ESR1 (0.51) | ALDH1A1MAPTTRPA1TSHRMEN1 | |
| SCHEMBL9697453 | 0.87 | SMPD1 (0.58) | ALDH1A1MAPTTSHRGAASMPD1 | |
| SCHEMBL9697391 | 0.87 | SMPD1 (0.58) | ALDH1A1MAPTTSHRGAASMPD1 | |
| SCHEMBL10759200 | 0.85 | MAPT (0.50) | ALDH1A1POLBMAPTGPR55TRPA1 | |
| SCHEMBL294390 | 0.84 | ALDH1A1 (0.58) | ALDH1A1MAPTTRPA1TSHRMEN1 | |
| SCHEMBL11061818 | 0.84 | TRPA1 (0.55) | ALDH1A1POLBMAPTGPR55TRPA1 | |
| SCHEMBL2442358 | 0.82 | MAOB (0.55) | ALDH1A1POLBMAPTMEN1KMT2A | |
| SCHEMBL4392029 | 0.82 | ESR1 (0.48) | ALDH1A1POLBMAPTMEN1KMT2A | |
| SCHEMBL30118840 | 0.82 | MAOB (0.55) | ALDH1A1POLBMAPTMEN1KMT2A | |
| SCHEMBL3032513 | 0.82 | MAPT (0.54) | ALDH1A1POLBMAPTGPR55MEN1 |
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-106748671-B | Method for synthesizing 2-alkoxy-4-methylphenol from 2-bromo-4-methylphenol | 浙江新和成股份有限公司 | 2019-12-24 | — | — | CN | disclosed |
| US-RE45364-E1 | Cyclic amine compound and pest control agent | NIPPON SODA CO., LTD. (JP) | 2015-02-03 | — | — | US | disclosed |
| EP-1955697-B1 | 2-AMINOBENZAMIDE DERIVATIVES AS VANILLOID RECEPTOR 1 (VR1) INHIBITORS USEFUL FOR THE TREATMENT OF PAIN OR BLADDER FUNCTION DISORDER | ASTELLAS PHARMA INC (JP) | 2012-05-02 | — | — | EP | disclosed |