Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.83 |
| ▸ | IDO1 | P14902 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | AGXT | P21549 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 4/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | TACR1 | P25103 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL28758135 | 0.94 | TSHR (0.94) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL27380 | 0.91 | TSHR (1.00) | TSHRIDO1KDM4EPOLBAGXT | |
| Benzene SCHEMBL27997624 | 0.91 | TSHR (1.00) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL5311581 | 0.91 | TSHR (1.00) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL28758137 | 0.89 | TSHR (0.83) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL7243519 | 0.89 | TSHR (0.83) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL9725547 | 0.88 | TSHR (0.94) | TSHRIDO1KDM4EPOLBAGXT | |
| Potassium SCHEMBL586337 | 0.88 | TSHR (0.94) | TSHRIDO1KDM4EPOLBAGXT | |
| Methane SCHEMBL11192510 | 0.88 | TSHR (0.94) | TSHRIDO1KDM4EPOLBAGXT | |
| SCHEMBL10317949 | 0.88 | TSHR (0.94) | TSHRIDO1KDM4EPOLBAGXT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011041529-A2 | TRI-2-NAPHTHYLAMINES | ARIZONA BOARD OF REGENTS ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2011-04-07 | — | — | WO | disclosed |
| US-5625067-A | Cyclopentane ether derivatives, processes for their production, and their pharmaceutical use | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-04-29 | — | — | US | disclosed |