Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP1 | O94782 | 9/20 | 0.52 |
| ▸ | WDR48 | Q8TAF3 | 9/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8390254 | 0.83 | USP1 (0.55) | USP1WDR48CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10783430 | 0.82 | CYP1A2 (0.50) | USP1WDR48CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL6417704 | 0.76 | PIK3CD (0.47) | CYP1A2TSHRALDH1A1MAPK1MEN1 | |
| SCHEMBL7011881 | 0.76 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19TSHRHSD17B10 | |
| SCHEMBL29904766 | 0.76 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19TSHRHSD17B10 | |
| SCHEMBL30523855 | 0.76 | ALDH1A1 (0.52) | CYP1A2CYP3A4CYP2C19TSHRHSD17B10 | |
| SCHEMBL2488050 | 0.74 | CYP1A2 (0.48) | USP1WDR48CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1454614 | 0.73 | CYP1A2 (0.41) | USP1WDR48CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL27964563 | 0.72 | CYP1A2 (0.69) | CYP1A2CYP3A4CYP2C19TSHRHSD17B10 | |
| SCHEMBL4107384 | 0.72 | NPC1 (0.56) | CYP1A2CYP3A4TSHRALDH1A1CYP2D6 |
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-2009003669-A2 | PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT | 4 AZA IP NV (BE) | 2009-01-08 | — | — | WO | disclosed |