Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL102552 | 0.82 | PTK2 (0.54) | ALDH1A1ALOX15MAPK1MAPTMEN1 | |
| SCHEMBL29363736 | 0.82 | PTK2 (0.54) | ALDH1A1ALOX15MAPK1MAPTMEN1 | |
| Hydrochloric Acid SCHEMBL10335452 | 0.78 | PTK2 (0.50) | ALDH1A1ALOX15MEN1KMT2APTK2 | |
| Hydrochloric Acid SCHEMBL10335450 | 0.78 | PTK2 (0.50) | ALDH1A1ALOX15MEN1KMT2APTK2 | |
| SCHEMBL109380 | 0.76 | — | — | |
| SCHEMBL57179 | 0.76 | — | — | |
| SCHEMBL29849481 | 0.76 | — | — | |
| SCHEMBL2536617 | 0.74 | ALDH1A1 (0.41) | ALDH1A1KDM1AKDM1BMAPTMEN1 | |
| SCHEMBL241198 | 0.74 | ALDH1A1 (0.42) | ALDH1A1KDM1AKDM1BMAPTMEN1 | |
| SCHEMBL29902922 | 0.74 | ALDH1A1 (0.42) | ALDH1A1KDM1AKDM1BMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113683601-A | Diaza-benzo-fluoranthene compound and preparation method and application thereof | 广东工业大学 | 2021-11-23 | — | — | CN | claimed |
| CN-113683601-B | Diaza-benzo-fluoranthene compound and preparation method and application thereof | 广东工业大学 | 2022-09-20 | — | — | CN | disclosed |
| CN-113683601-A | Diaza-benzo-fluoranthene compound and preparation method and application thereof | 广东工业大学 | 2021-11-23 | — | — | CN | disclosed |