Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.31 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4794177 | 1.00 | ALDH1A1 (0.37) | ALDH1A1HTR1AOPRM1OPRD1APOBEC3A | |
| SCHEMBL4795186 | 0.94 | ALDH1A1 (0.36) | ALDH1A1HTR1APDE4D | |
| SCHEMBL4795177 | 0.94 | ALDH1A1 (0.36) | ALDH1A1HTR1APDE4D | |
| SCHEMBL4726527 | 0.91 | ALDH1A1 (0.39) | ALDH1A1OPRM1OPRD1APOBEC3AAPOBEC3G | |
| SCHEMBL4726531 | 0.91 | ALDH1A1 (0.39) | ALDH1A1OPRM1OPRD1APOBEC3AAPOBEC3G | |
| SCHEMBL4795067 | 0.85 | ALDH1A1 (0.38) | ALDH1A1OPRM1OPRD1PDE4D | |
| SCHEMBL4795076 | 0.85 | ALDH1A1 (0.38) | ALDH1A1OPRM1OPRD1PDE4D | |
| SCHEMBL4138722 | 0.84 | APOBEC3A (0.33) | APOBEC3AAPOBEC3GPDE4D | |
| SCHEMBL4138718 | 0.84 | APOBEC3A (0.33) | APOBEC3AAPOBEC3GPDE4D | |
| SCHEMBL4794493 | 0.84 | CYP2E1 (0.34) | ALDH1A1APOBEC3AAPOBEC3G |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008017688-A1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-14 | — | — | WO | disclosed |