Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAALAD2 | Q9Y3Q0 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 7/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL223316 | 0.92 | NAALAD2 (0.53) | NAALAD2CNR1CNR2ESR1CYP3A4 | |
| Propylene Glycol SCHEMBL5088694 | 0.84 | NAALAD2 (0.44) | NAALAD2CNR1CNR2ESR1CYP3A4 | |
| Propionic Acid SCHEMBL11105024 | 0.81 | ESR1 (0.47) | ESR1CYP3A4CYP1A2LMNAPGR | |
| SCHEMBL2538851 | 0.81 | TBXAS1 (0.47) | NAALAD2CNR1CNR2ESR1CYP3A4 | |
| Butyric Acid SCHEMBL11106803 | 0.81 | HSD17B3 (0.44) | NAALAD2CNR1CNR2ESR1CYP3A4 | |
| Hydroquinone SCHEMBL8616475 | 0.79 | FFAR3 (0.59) | ESR1CYP3A4CYP1A2LMNAPGR | |
| Hydroquinone SCHEMBL9067666 | 0.79 | FFAR3 (0.59) | ESR1CYP3A4CYP1A2LMNAPGR | |
| SCHEMBL51338 | 0.79 | TBXAS1 (0.54) | NAALAD2CNR1CNR2ESR1CYP3A4 | |
| SCHEMBL1433579 | 0.79 | ESR1 (0.50) | NAALAD2ESR1CYP3A4CYP1A2LMNA | |
| SCHEMBL8402189 | 0.79 | KMT2A (0.52) | CNR1CNR2CYP1A2CYP2C19SLC6A3 |
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-4466902-A | Rust inhibitor | IPPOSHA OIL INDUSTRIES, CO., LTD. (JP) | 1984-08-21 | — | — | US | disclosed |