Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | RXRB | P28702 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CETP | P11597 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7998432 | 0.98 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4EALOX5GAA | |
| SCHEMBL16595947 | 0.88 | GRIN2B (0.42) | ALDH1A1MAPTCA2ADRA2ARXRB | |
| SCHEMBL9720050 | 0.86 | TSHR (0.46) | ALDH1A1MAPTADRA2ARXRBADRA2B | |
| SCHEMBL81351 | 0.86 | RXRB (0.42) | ALDH1A1CA2ADRA2ARXRBADRA2B | |
| SCHEMBL9392878 | 0.84 | BCHE (0.48) | CA2ADRA2ARXRBALOX15 | |
| SCHEMBL2633408 | 0.82 | GRIN2B (0.46) | ALDH1A1MAPTADRA2ARXRBADRA2B | |
| SCHEMBL1465705 | 0.80 | RXRB (0.46) | ALDH1A1MAPTADRA2ARXRBADRA2B | |
| SCHEMBL10118337 | 0.80 | GRIN2B (0.45) | ALDH1A1MAPTADRA2ARXRBADRA2B | |
| SCHEMBL22369581 | 0.79 | GRIN2B (0.44) | CA2ALOX15 | |
| SCHEMBL9711010 | 0.79 | DRD2 (0.39) | RXRBCETP |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5696162-A | ANTIINFLAMMATORY AGENTS, SKIN DISORDERS, AUTOIMMUNE DISORDERS | ALLERGAN (US) | 1997-12-09 | — | — | US | disclosed |
| US-5677320-A | SKIN DISORDERS, ANTIGROWTH AGENT, IMMUNOLOGY DISORDERS | ALLERGAN (US) | 1997-10-14 | — | — | US | disclosed |
| EP-0724579-A1 | PHENYL OR HETEROARYL AND TETRAHYDRONAPHTHYL SUBSTITUTED DIENE COMPOUNDS HAVING RETINOID LIKE BIOLOGICAL ACTIVITY | Allergan (US) | 1996-08-07 | — | — | EP | disclosed |
| EP-0699178-A1 | TETRAHYDRONAPHTHYL AND CYCLOPROPYL SUBSTITUTED 1,3-BUTADIENES HAVING RETINOID-LIKE ACTIVITY | ALLERGAN, INC. (US) | 1996-03-06 | — | — | EP | disclosed |