Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.43 |
| ▸ | MAP2K6 | P52564 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | MAP3K19 | Q56UN5 | 1/20 | 0.43 |
| ▸ | NEK10 | Q6ZWH5 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6924491 | 0.80 | ATM (0.45) | ACHETDP1L3MBTL1HSD17B10ATM | |
| SCHEMBL28280694 | 0.78 | ACHE (0.50) | ACHEBCHEHSD17B10TP53ALDH1A1 | |
| SCHEMBL28281977 | 0.76 | KDM4E (0.50) | ACHEL3MBTL1BCHEHSD17B10TP53 | |
| SCHEMBL28263786 | 0.74 | L3MBTL1 (0.66) | ACHETDP1L3MBTL1BCHEATM | |
| SCHEMBL560134 | 0.73 | L3MBTL1 (0.65) | ACHETDP1L3MBTL1BCHEHSD17B10 | |
| SCHEMBL13861857 | 0.73 | PRKAA2 (0.65) | ACHEBCHEDHODHALDH1A1GAA | |
| SCHEMBL4703657 | 0.71 | TDP1 (0.58) | ACHETDP1L3MBTL1BCHEHSD17B10 | |
| SCHEMBL9107151 | 0.71 | ACHE (0.82) | ACHETDP1BCHEHSD17B10TP53 | |
| SCHEMBL9770657 | 0.70 | KDM4E (0.49) | ACHETDP1L3MBTL1BCHEHSD17B10 | |
| SCHEMBL15621993 | 0.70 | HRH2 (0.43) | KDM4EMAPT |
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-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | disclosed |