Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6691437 | 0.90 | TSHR (0.54) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| SCHEMBL28286382 | 0.88 | TSHR (0.52) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| SCHEMBL27798162 | 0.83 | TSHR (0.48) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| Cyanate SCHEMBL10695476 | 0.80 | SRC (0.48) | TSHRKDM4ECYP2C9CYP2C19 | |
| Carbamic Acid SCHEMBL27866020 | 0.78 | CYP3A4 (0.47) | CYP3A4TSHRLMNAALDH1A1PTK2B | |
| SCHEMBL1974047 | 0.77 | TSHR (0.54) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| SCHEMBL27549937 | 0.77 | TSHR (0.41) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| SCHEMBL2354339 | 0.76 | CA2 (0.43) | LMNAALDH1A1CYP2A6KDM4EGAA | |
| SCHEMBL28462057 | 0.74 | CYP3A4 (0.47) | CYP3A4TSHRLMNAACHEALDH1A1 | |
| SCHEMBL869948 | 0.74 | TSHR (0.50) | CYP3A4TSHRLMNAACHEALDH1A1 |
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-109585920-A | Lithium ion battery and its electrolyte | 欣旺达电子股份有限公司 | 2019-04-05 | — | — | CN | claimed |
| CN-108863851-A | A kind of branching type water-based carbodiimides type crosslinking agent and preparation method thereof | 成都创世芯研科技有限公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-104932155-B | Sealant for liquid crystal dripping process, upper and lower conductive material and liquid crystal display cells | 积水化学工业株式会社 | 2018-04-03 | — | — | CN | disclosed |