Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.73 |
| ▸ | F7 | P08709 | 6/20 | 0.73 |
| ▸ | F3 | P13726 | 6/20 | 0.73 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.73 |
| ▸ | PPARG | P37231 | 5/20 | 0.73 |
| ▸ | PPARD | Q03181 | 4/20 | 0.73 |
| ▸ | PPARA | Q07869 | 4/20 | 0.73 |
| ▸ | OXER1 | Q8TDS5 | 4/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.73 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.73 |
| ▸ | MAPT | P10636 | 3/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.73 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.73 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.73 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.73 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.73 |
| ▸ | HPGD | P15428 | 2/20 | 0.73 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.73 |
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 | |
|---|---|---|---|---|
| SCHEMBL9183250 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL9881028 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL15908482 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL19651150 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL15908474 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL16272971 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL23950586 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL15908472 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL10734659 | 1.00 | ALDH1A1 (0.73) | ALDH1A1F7F3CYP19A1PPARG | |
| SCHEMBL15908484 | 0.98 | ALDH1A1 (0.70) | ALDH1A1F7F3CYP19A1PPARG |
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-4676834-A | Novel compositions prepared from methyl substituted nitrogen-containing aromatic heterocyclic compounds and an aldehyde or ketone | THE DOW CHEMICAL COMPANY (US) | 1987-06-30 | — | — | US | disclosed |