Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.40 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 8/20 | 0.33 |
| ▸ | RARB | P10826 | 8/20 | 0.33 |
| ▸ | RARG | P13631 | 8/20 | 0.33 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 2/20 | 0.31 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7703541 | 1.00 | GRIK1 (0.40) | GRIK1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL7136227 | 0.86 | RARA (0.48) | RARARARBRARGRXRANR2E1 | |
| SCHEMBL7139166 | 0.86 | RARA (0.48) | RARARARBRARGRXRANR2E1 | |
| SCHEMBL7143918 | 0.80 | RARB (0.45) | RARARARBRARGMAPTKDM4E | |
| SCHEMBL7143911 | 0.80 | RARB (0.45) | RARARARBRARGMAPTKDM4E | |
| SCHEMBL7703545 | 0.80 | — | — | |
| SCHEMBL7140496 | 0.79 | ALDH1A1 (0.32) | KDM4EALDH1A1 | |
| SCHEMBL18247318 | 0.73 | GRIK1 (0.40) | GRIK1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL7142149 | 0.72 | RARB (0.48) | RARARARBRARG | |
| SCHEMBL7139242 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1212316-A2 | BENZOPYRANS AND BENZOTHIOPYRANS AS RAR SELECTIVE RETINOID AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001014360-A2 | BENZOPYRANS AND BENZOTHIOPYRANS AS RAR SELECTIVE RETINOID AGONISTS | F. HOFFMAN-LA ROCHE AG (CH) | 2001-03-01 | — | — | WO | disclosed |