Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 6/20 | 0.67 |
| ▸ | RARG | P13631 | 6/20 | 0.67 |
| ▸ | RARA | P10276 | 4/20 | 0.67 |
| ▸ | RXRA | P19793 | 9/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8603410 | 0.82 | RARB (0.65) | RARBRARGRARARXRAGABRA1 | |
| SCHEMBL8616526 | 0.78 | RARB (0.42) | RARBRARGRARAGABRA1GABRG2 | |
| SCHEMBL7710016 | 0.76 | RARA (0.57) | RARBRARGRARARXRA | |
| SCHEMBL8634937 | 0.75 | RARB (0.74) | RARBRARGRARARXRA | |
| SCHEMBL7703905 | 0.75 | RARA (0.56) | RARBRARGRARARXRABACE1 | |
| SCHEMBL9091776 | 0.71 | RARA (0.51) | RARBRARGRARARXRA | |
| SCHEMBL8631884 | 0.70 | RARB (0.63) | RARBRARGRARAGABRA1GABRG2 | |
| SCHEMBL9273777 | 0.69 | RARB (0.36) | RARBRARGRARAGABRA1GABRG2 | |
| SCHEMBL5737805 | 0.69 | RARB (0.35) | RARBRARGRARAGABRA1GABRG2 | |
| SCHEMBL8633754 | 0.68 | RARB (0.80) | RARBRARGRARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0825986-A1 | QUINOLYL-ETHYNYL DERIVATIVES HAVING RETINOID-LIKE ACTIVITY | Allergan (US) | 1998-03-04 | — | — | EP | disclosed |
| US-5616712-A | SKIN DISORDERS; ANTICARCINOGENIC AND -INFLAMMATORY AGENTS; AUTOIMMUNE DISEASES; | ALLERGAN (US) | 1997-04-01 | — | — | US | disclosed |
| WO-1996036609-A1 | QUINOLYL-ETHYNYL DERIVATIVES HAVING RETINOID-LIKE ACTIVITY | ALLERGAN (US) | 1996-11-21 | — | — | WO | disclosed |