Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | STS | P08842 | 4/20 | 0.36 |
| ▸ | CEL | P19835 | 2/20 | 0.35 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.35 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824269 | 1.00 | CYP1B1 (0.40) | CYP1B1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL6829521 | 0.98 | CYP1B1 (0.38) | CYP1B1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL17292515 | 0.94 | CYP1B1 (0.35) | CYP1B1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL6827261 | 0.90 | MAPT (0.38) | CYP1B1MAPTTDP1 | |
| SCHEMBL6824851 | 0.85 | CYP1B1 (0.40) | CYP1B1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL6827176 | 0.84 | DAO (0.39) | MAPTDAO | |
| SCHEMBL6827665 | 0.79 | CYP1B1 (0.41) | CYP1B1MAPTKMT2ASTSCEL | |
| SCHEMBL6829594 | 0.78 | MAPT (0.34) | MAPTDAO | |
| SCHEMBL6827998 | 0.78 | TDP1 (0.49) | CYP1B1MAPTKMT2AMEN1STS | |
| SCHEMBL6827603 | 0.78 | TDP1 (0.49) | CYP1B1MAPTKMT2AMEN1STS |
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-2004050624-A1 | SUBSTITUTED 1H-PYRIDINE-2-ONE DERIVATIVES | C & C RESEARCH LABORATORIES (KR) | 2004-06-17 | — | — | WO | disclosed |