Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NAT1 | P18440 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL227808 | 0.90 | KIF18A (0.57) | KIF18ALMNANPSR1CNR2CYP3A4 | |
| SCHEMBL7643603 | 0.86 | PTGS2 (0.54) | KIF18ALMNANPSR1PTGS2PTGS1 | |
| SCHEMBL9452112 | 0.86 | HTT (0.49) | KIF18APTGS2CNR2SMN1; SMN2L3MBTL1 | |
| SCHEMBL29094192 | 0.86 | S100A4 (0.45) | PTGS2PTGS1CYP3A4ALDH1A1MAPK1 | |
| SCHEMBL2019763 | 0.80 | KIF18A (0.55) | KIF18ALMNANPSR1PTGS2PTGS1 | |
| SCHEMBL5161585 | 0.79 | PTGS2 (0.54) | KIF18ALMNANPSR1PTGS2PTGS1 | |
| SCHEMBL228959 | 0.79 | KIF18A (0.57) | KIF18ACNR2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL760785 | 0.77 | ACLY (0.48) | NPSR1PTGS2PTGS1CYP1A2ALDH1A1 | |
| SCHEMBL9452111 | 0.77 | PGR (0.49) | CYP3A4ALDH1A1MAPK1SMN1; SMN2L3MBTL1 | |
| SCHEMBL13731761 | 0.77 | PTGS2 (0.56) | LMNANPSR1PTGS2PTGS1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5051495-A | Reaction of dialcohol, dithiols with aromatic halogen compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-09-24 | — | — | US | disclosed |
| EP-0292211-A2 | Production and/or handling of polymers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-11-23 | — | — | EP | disclosed |