Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | BLM | P54132 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | METAP1 | P53582 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5483717 | 0.85 | GAA (0.63) | CYP1A2CYP2C9BLMKMT2ACYP2D6 | |
| SCHEMBL30081024 | 0.83 | CYP1A2 (0.52) | CYP1A2CYP2C9BLMKMT2ACYP2D6 | |
| SCHEMBL30081029 | 0.83 | CYP1A2 (0.49) | CYP1A2CYP2C9BLMKMT2ACYP2D6 | |
| SCHEMBL30081025 | 0.80 | KDM4E (0.76) | CYP1A2CYP2C9BLMKMT2ACYP2D6 | |
| SCHEMBL30423972 | 0.78 | TDP1 (0.68) | CYP1A2BLMKDM4EL3MBTL1LMNA | |
| SCHEMBL1442585 | 0.78 | TDP1 (0.68) | CYP1A2BLMKDM4EL3MBTL1LMNA | |
| SCHEMBL26104778 | 0.76 | ALDH1A1 (0.37) | KMT2AKDM4EALDH1A1L3MBTL1MEN1 | |
| SCHEMBL30929759 | 0.76 | ALDH1A1 (0.37) | KMT2AKDM4EALDH1A1L3MBTL1MEN1 | |
| SCHEMBL4490247 | 0.75 | CCR1 (0.63) | CYP1A2BLMKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL29545764 | 0.75 | CCR1 (0.63) | CYP1A2BLMKDM4EALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022239808-A1 | COMPOUND HAVING ANTIPARASITIC ACTIVITY | 国立研究開発法人理化学研究所 | 2022-11-17 | — | — | WO | disclosed |