Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.53 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9743847 | 0.99 | MCHR1 (0.52) | MCHR1AHRRARBCYP3A4CYP2D6 | |
| SCHEMBL9743290 | 0.99 | MCHR1 (0.52) | MCHR1AHRRARBCYP3A4CYP2D6 | |
| SCHEMBL9742623 | 0.97 | MCHR1 (0.56) | MCHR1AHRRARBCYP3A4CYP2D6 | |
| SCHEMBL9742375 | 0.96 | MCHR1 (0.56) | MCHR1AHRRARBCYP3A4CYP2D6 | |
| SCHEMBL9744024 | 0.96 | AHR (0.50) | MCHR1AHRALDH1A1HPGDHTT | |
| SCHEMBL9742615 | 0.94 | AHR (0.49) | MCHR1AHRKDM4EALDH1A1HPGD | |
| SCHEMBL9742363 | 0.94 | AHR (0.49) | MCHR1AHRKDM4EALDH1A1HPGD | |
| SCHEMBL9743201 | 0.93 | MCHR1 (0.58) | MCHR1AHRCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL9742462 | 0.93 | RARB (0.49) | MCHR1RARBCYP3A4CYP2D6KDM4E | |
| SCHEMBL9744005 | 0.93 | RARB (0.49) | MCHR1RARBCYP3A4CYP2D6KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5084204-A | Naphthylacetylenes | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-01-28 | — | — | US | disclosed |