Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | ADK | P55263 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1042470 | 0.91 | CYP2A6 (0.42) | MAOACYP2A6CYP1A2ALDH1A1HPGD | |
| SCHEMBL31566350 | 0.91 | CYP2A6 (0.42) | MAOACYP2A6CYP1A2ALDH1A1HPGD | |
| SCHEMBL5080119 | 0.90 | DHFR (0.40) | DHFRMAOAMAOBCYP2A6CYP1A2 | |
| SCHEMBL2949327 | 0.87 | DHFR (0.40) | DHFRMAOAMAOBCYP2A6CYP1A2 | |
| SCHEMBL30616100 | 0.86 | DNMT1 (0.40) | DHFRCYP2A6GSK3BADKALDH1A1 | |
| SCHEMBL29368065 | 0.86 | DNMT1 (0.40) | DHFRCYP2A6GSK3BADKALDH1A1 | |
| SCHEMBL275907 | 0.86 | DNMT1 (0.40) | DHFRCYP2A6GSK3BADKALDH1A1 | |
| SCHEMBL29096076 | 0.86 | CYP1A2 (0.42) | DHFRMAOAMAOBCYP2A6CYP1A2 | |
| SCHEMBL3629384 | 0.85 | DHFR (0.37) | DHFRMAOAMAOBCYP2A6CYP1A2 | |
| SCHEMBL8595804 | 0.84 | DNMT1 (0.39) | DHFRCYP2A6GSK3BADKALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5532402-A | Process for producing optically active hydroxyalkylphosphonates | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1996-07-02 | — | — | US | disclosed |