Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 3/20 | 0.43 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9745437 | 1.00 | NR5A1 (0.47) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9743380 | 0.99 | NR5A1 (0.45) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9743988 | 0.96 | DRD2 (0.44) | NR5A1LTA4HKCNH2 | |
| SCHEMBL9742430 | 0.94 | RARB (0.45) | NR5A1LTA4HKDM4EALDH1A1HPGD | |
| SCHEMBL9743193 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9743091 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9742605 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9742442 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9743638 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H | |
| SCHEMBL9743552 | 0.94 | NR5A1 (0.53) | NR5A1THRATSHRTP53LTA4H |
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 |