Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 9/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | USP7 | Q93009 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8433145 | 0.85 | EGLN1 (0.39) | USP7CNR2PDCD1CD274 | |
| SCHEMBL8532684 | 0.80 | ENPP2 (0.35) | S1PR1CYP2C9ALDH1A1GAA | |
| SCHEMBL10980808 | 0.68 | ADRA2C (0.68) | ADRA2CUSP7CYP2D6CNR2PTGDR2 | |
| SCHEMBL6166508 | 0.68 | ADRA2C (0.56) | ADRA2CCYP2D6CHRM3ALDH1A1PTGDR2 | |
| SCHEMBL19209427 | 0.67 | PPARG (0.44) | ADRA2CCYP2D6CNR2PDCD1CD274 | |
| SCHEMBL5426031 | 0.67 | PTGDR2 (0.55) | ADRA2CALDH1A1PTGDR2 | |
| SCHEMBL8432620 | 0.67 | F10 (0.38) | — | |
| SCHEMBL9357799 | 0.65 | CYP4F2 (0.62) | PDCD1CD274ALDH1A1GAA | |
| SCHEMBL19209418 | 0.64 | PPARG (0.44) | CYP2C9CYP2D6CNR2PDCD1CD274 | |
| SCHEMBL12648685 | 0.63 | CYP11B2 (0.44) | ADRA2CS1PR1CYP2C9USP7CYP2D6 |
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-5773646-A | INTEGRIN INHIBITORS | G. D. SEARLE & CO. (US) | 1998-06-30 | — | — | US | disclosed |