Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.61 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 5/20 | 0.61 |
| ▸ | PGR | P06401 | 5/20 | 0.61 |
| ▸ | USP2 | O75604 | 3/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.61 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | MLNR | O43193 | 1/20 | 0.61 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.61 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.61 |
| ▸ | PPARG | P37231 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.60 |
| ▸ | DRD2 | P14416 | 1/20 | 0.60 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL10789008 | 0.91 | CYP3A4 (0.63) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL19726399 | 0.90 | CYP3A4 (0.64) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11230537 | 0.89 | CYP3A4 (0.59) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11481548 | 0.89 | CYP3A4 (0.72) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11126098 | 0.89 | CYP3A4 (0.72) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11220809 | 0.89 | CYP3A4 (0.62) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL19726403 | 0.88 | NR3C1 (0.72) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11811751 | 0.85 | CYP3A4 (0.58) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL11811743 | 0.85 | CYP3A4 (0.58) | CYP3A4NR3C1LMNAPGRUSP2 | |
| SCHEMBL19726402 | 0.83 | NR3C1 (0.67) | CYP3A4NR3C1LMNAPGRUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4650610-A | Androstane carbothioic acids | GLAXO GROUP LIMITED (GB) | 1987-03-17 | — | — | US | disclosed |
| US-4578221-A | Androstane carbothioic acids | GLAXO GROUP LIMITED (GB) | 1986-03-25 | — | — | US | disclosed |
| US-4335121-A | TOPICAL ANTIINFLAMMATORY AGENTS | GLAXO GROUP LIMITED (GB) | 1982-06-15 | — | — | US | disclosed |