Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGA | O60502 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15740608 | 0.85 | OGA (0.42) | OGAALDH1A1KDM4EHTR1ANPSR1 | |
| SCHEMBL4327175 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KDM4EHTR1ANPSR1TSHR | |
| SCHEMBL5458684 | 0.81 | OGA (0.44) | OGAALDH1A1KDM4EKDM1ATSHR | |
| SCHEMBL4500980 | 0.77 | GRIN2D (0.42) | ALDH1A1HTR1AAOC3 | |
| SCHEMBL4945954 | 0.75 | SLC6A7 (0.46) | OGAALDH1A1KDM4EKDM1ATSHR | |
| SCHEMBL6800518 | 0.73 | ACHE (0.55) | OGAKDM4EPTPN11ACHE | |
| SCHEMBL5458689 | 0.73 | ACHE (0.56) | OGAPTPN11ACHE | |
| SCHEMBL4486164 | 0.73 | HTR1A (0.55) | ALDH1A1KDM4EHTR1ANPSR1SMN1; SMN2 | |
| SCHEMBL15740759 | 0.72 | KDM4E (0.49) | ALDH1A1KDM4ENPSR1KDM1ASMN1; SMN2 | |
| SCHEMBL4510839 | 0.72 | SORD (0.49) | HTR1AAOC3 |
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-7491821-B2 | 2-(4-fluorophenyl)-4-propyl-oxazole-5-carboxylic acid {2-[4-(6-aminopyridin-2-yl)-piperazin-1-yl]-1-methyl-ethyl}amide; purinergic receptor antagonists, analgesics; urogenital, gastointestinal and respiratory system disorders | ROCHE PALO ALTO LLC (US) | 2009-02-17 | — | — | US | disclosed |