Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 6/20 | 0.40 |
| ▸ | AR | P10275 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL15625191 | 0.83 | TYR (0.45) | CYP3A4CYP2D6HIF1ARORCSHBG | |
| SCHEMBL11205971 | 0.82 | CNR2 (0.56) | RORCESR1ESR2CNR1CNR2 | |
| SCHEMBL5709988 | 0.76 | SHBG (0.52) | CYP3A4CYP2D6HIF1ARORCSHBG | |
| SCHEMBL28308818 | 0.76 | RORC (0.49) | CYP3A4CYP2D6HIF1ARORCSHBG | |
| SCHEMBL9355691 | 0.76 | ESR1 (0.61) | CYP3A4CYP2D6HIF1ASHBGESR1 | |
| SCHEMBL29516743 | 0.75 | CYP3A4 (0.51) | CYP3A4CYP2D6HIF1ARORCSHBG | |
| SCHEMBL11878851 | 0.75 | LMNA (0.46) | ESR1MEN1USP2TP53MAPT | |
| SCHEMBL51093 | 0.75 | RORC (0.57) | CYP3A4CYP2D6HIF1ARORCESR1 | |
| SCHEMBL2860364 | 0.75 | TYR (0.46) | ESR1ESR2LMNATSHRGABRA1 | |
| SCHEMBL4265490 | 0.74 | NPC1 (0.39) | SHBGSMN1; SMN2MEN1USP2MAPT |
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-4347180-A | High caustic coupling process for preparing substituted 2-nitro-2'-hydroxyazobenzenes | CIBA-GEIGY CORPORATION (US) | 1982-08-31 | — | — | US | disclosed |
| US-4315848-A | PROTECTIVE COATING FOR AUTOMOBILES | CIBA-GEIGY CORPORATION (US) | 1982-02-16 | — | — | US | disclosed |
| US-4278589-A | 2-[2-Hydroxy-3,5-di-(α,α-dimethylbenzyl)phenyl]-2H-benzotriazole and stabilized compositions | CIBA-GEIGY CORPORATION (US) | 1981-07-14 | — | — | US | disclosed |
| US-4275004-A | High caustic coupling process for preparing substituted 2-nitro-2'-hydroxyazobenzenes | CIBA-GEIGY CORPORATION (US) | 1981-06-23 | — | — | US | disclosed |