Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CDC25B | P30305 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14380302 | 1.00 | CYP3A4 (0.43) | CYP3A4CYP1A2CYP2D6ATMMAPK9 | |
| SCHEMBL19764656 | 1.00 | CYP3A4 (0.43) | CYP3A4CYP1A2CYP2D6ATMMAPK9 | |
| SCHEMBL1758755 | 0.83 | MAOA (0.53) | CDC25BALDH1A1KMT2AMEN1CTSL | |
| SCHEMBL28696126 | 0.83 | CDC25B (0.53) | CDC25BALDH1A1TDP1KMT2AMEN1 | |
| SCHEMBL23503663 | 0.80 | MAPK9 (0.43) | ATMMAPK9MAPK10NCOA1NCOA3 | |
| SCHEMBL17878976 | 0.77 | ALDH1A1 (0.46) | CYP3A4CYP1A2CYP2D6ATMMAPK9 | |
| SCHEMBL20829704 | 0.77 | ATM (0.39) | CYP3A4CYP1A2CYP2D6ATMMAPK9 | |
| SCHEMBL20829703 | 0.77 | ATM (0.36) | CYP3A4CYP1A2CYP2D6ATMMAPK9 | |
| SCHEMBL22929944 | 0.75 | ATM (0.38) | CYP3A4CYP1A2ATMMAPK9MAPK10 | |
| SCHEMBL22891154 | 0.74 | GABRG2 (0.52) | CYP3A4CYP1A2CYP2D6MAPK9CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240215277-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | US | disclosed |
| US-20240215277-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | US | disclosed |