Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | ICMT | O60725 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 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 | |
|---|---|---|---|---|
| SCHEMBL19809331 | 0.79 | ALDH1A1 (0.39) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL4622011 | 0.74 | ALDH1A1 (0.39) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL24400590 | 0.72 | ALDH1A1 (0.38) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL11432661 | 0.70 | ALDH1A1 (0.41) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL10641405 | 0.68 | CYP1A2 (0.39) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL10641415 | 0.68 | CYP1A2 (0.39) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL10641412 | 0.68 | CYP1A2 (0.39) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL1550619 | 0.68 | ALDH1A1 (0.35) | ALDH1A1LMNAGAAPAX8MCL1 | |
| SCHEMBL7550872 | 0.67 | TSHR (0.40) | LMNAGAAMCL1OPRM1OPRK1 | |
| SCHEMBL727037 | 0.67 | MEN1 (0.35) | ALDH1A1LMNAGAAPAX8MCL1 |
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-4740624-A | Process for the preparation of ketones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-04-26 | — | — | US | disclosed |