Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.34 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22101508 | 0.90 | CYP3A4 (0.50) | CYP3A4TDP1ESR1ESR2ALOX5 | |
| SCHEMBL13572520 | 0.86 | CYP3A4 (0.55) | CYP3A4TDP1ESR1ESR2MAOA | |
| SCHEMBL27456368 | 0.86 | CYP3A4 (0.60) | CYP3A4TDP1ESR1ESR2MAOA | |
| SCHEMBL19480054 | 0.85 | CYP3A4 (0.44) | CYP3A4TDP1ESR1ESR2MAOA | |
| SCHEMBL4451573 | 0.84 | CYP3A4 (0.55) | CYP3A4TDP1ESR1ESR2MAOA | |
| SCHEMBL23432303 | 0.82 | MEN1 (0.48) | CYP3A4ESR1MAOAALOX5JAK2 | |
| SCHEMBL14958604 | 0.82 | MEN1 (0.48) | CYP3A4ESR1MAOAALOX5JAK2 | |
| SCHEMBL22173462 | 0.82 | MEN1 (0.48) | CYP3A4ESR1MAOAALOX5JAK2 | |
| SCHEMBL20431790 | 0.82 | MEN1 (0.48) | CYP3A4ESR1MAOAALOX5JAK2 | |
| SCHEMBL25669185 | 0.82 | MEN1 (0.48) | CYP3A4ESR1MAOAALOX5JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3667755-A1 | ORGANIC LIGHT EMITTING DEVICE, A METHOD FOR MANUFACTURING THE SAME AND A COMPOSITION FOR USE THEREIN | Novaled GmbH (DE) | 2020-06-17 | — | — | EP | disclosed |