Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.44 |
| ▸ | CA2 | P00918 | 8/20 | 0.44 |
| ▸ | CA9 | Q16790 | 7/20 | 0.44 |
| ▸ | CA12 | O43570 | 6/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.38 |
| ▸ | EDNRB | P24530 | 1/20 | 0.37 |
| ▸ | EDNRA | P25101 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8908994 | 0.88 | MAOB (0.47) | CA1CA2CA9CA12CA4 | |
| SCHEMBL8551071 | 0.71 | NTRK1 (0.41) | CA1CA2CA9CA12CA4 | |
| SCHEMBL8908949 | 0.70 | ALOX5AP (0.40) | CA1CA2CA9CA12CA4 | |
| SCHEMBL6986037 | 0.69 | EDNRB (0.56) | EDNRBEDNRA | |
| SCHEMBL28477141 | 0.69 | LTA4H (0.46) | EDNRBEDNRAPTGS1PTGS2BRD4 | |
| SCHEMBL22412687 | 0.68 | MAOB (0.40) | CA1CA2CA9CA12CA4 | |
| SCHEMBL6026444 | 0.68 | BRD4 (0.43) | CA1CA2CA9CA12CA4 | |
| SCHEMBL3054443 | 0.68 | LTA4H (0.55) | — | |
| SCHEMBL5822874 | 0.66 | PTGS2 (0.54) | CA1CA2CA9CA12MAOB | |
| SCHEMBL28480268 | 0.66 | PIK3CA (0.39) | PIK3CG |
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-5719163-A | ARTHRITIS | G.D. SEARLE & CO. (US) | 1998-02-17 | — | — | US | disclosed |