Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28007983 | 0.80 | IDO1 (0.44) | CYP2A6BCHEACHEALDH1A1KDM4E | |
| SCHEMBL5759879 | 0.79 | IDO1 (0.47) | BCHEACHEALDH1A1KDM4ELMNA | |
| SCHEMBL29450783 | 0.79 | LOXL2 (0.47) | MAOAALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL12093432 | 0.79 | LOXL2 (0.47) | MAOAALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL25217482 | 0.78 | MAOA (0.52) | CYP2A6MAOAALDH1A1KDM4ELMNA | |
| SCHEMBL30751953 | 0.77 | MAOA (0.61) | CYP2A6MAOAALDH1A1KDM4ELMNA | |
| SCHEMBL10127076 | 0.77 | MAOA (0.59) | CYP2A6MAOAALDH1A1KDM4ELMNA | |
| SCHEMBL12473426 | 0.74 | CA1 (0.55) | CYP2A6ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL357145 | 0.74 | CA1 (0.61) | CYP2A6ALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL31116611 | 0.74 | CA1 (0.61) | CYP2A6ALDH1A1KDM4ELMNAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-117645631-A | Organic compound, hole transport layer material, and solar cell | 隆基绿能科技股份有限公司 | 2024-03-05 | — | — | CN | disclosed |