Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARG | P13631 | 15/20 | 0.72 |
| ▸ | RARB | P10826 | 15/20 | 0.72 |
| ▸ | RARA | P10276 | 14/20 | 0.72 |
| ▸ | RXRA | P19793 | 11/20 | 0.72 |
| ▸ | RXRG | P48443 | 6/20 | 0.72 |
| ▸ | RXRB | P28702 | 6/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.51 |
| ▸ | GMNN | O75496 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10399347 | 1.00 | RARG (0.72) | RARGRARBRARARXRARXRG | |
| SCHEMBL7219495 | 0.87 | RXRA (0.74) | RARGRARBRARARXRARXRG | |
| SCHEMBL7219497 | 0.87 | RXRA (0.74) | RARGRARBRARARXRARXRG | |
| SCHEMBL6428704 | 0.87 | RARB (0.54) | RARGRARBRARARXRARXRG | |
| SCHEMBL10399193 | 0.83 | RARB (0.51) | RARGRARBRARARXRARXRG | |
| SCHEMBL10399194 | 0.83 | RARB (0.51) | RARGRARBRARARXRARXRG | |
| Arotinoid SCHEMBL2890175 | 0.81 | RARG (0.70) | RARGRARBRARARXRARXRG | |
| Arotinoid SCHEMBL2890176 | 0.81 | RARG (0.70) | RARGRARBRARARXRARXRG | |
| Arotinoid SCHEMBL29430179 | 0.81 | RARG (0.70) | RARGRARBRARARXRARXRG | |
| SCHEMBL6427528 | 0.78 | RXRA (0.56) | RARGRARBRARARXRARXRG |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4931458-A | Heterocyclic rodenticidal compounds, compositions containing the compounds, and methods of use | HOFFMANN-LA ROCHE INC. (US) | 1990-06-05 | — | — | US | claimed |
| EP-0098591-B1 | HETEROCYCLIC COMPOUNDS AND RODENTICIDES CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1987-07-08 | — | — | EP | claimed |
| US-4931458-A | Heterocyclic rodenticidal compounds, compositions containing the compounds, and methods of use | HOFFMANN-LA ROCHE INC. (US) | 1990-06-05 | — | — | US | disclosed |
| US-4816476-A | BENZO(B)THIENYL GROUP OR BENZOFURAN SUBSTITUTED GROUPS | HOFFMANN-LA ROCHE INC. (US) | 1989-03-28 | — | — | US | disclosed |
| US-4659735-A | Benzofuranyl (thienyl) propenyl derivatives useful as rodenticides | HOFFMANN-LA ROCHE INC. (US) | 1987-04-21 | — | — | US | disclosed |
| US-4535086-A | RODENTICIDES | HOFFMANN-LA ROCHE INC. (US) | 1985-08-13 | — | — | US | disclosed |