Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL6436811 | 0.78 | — | — | |
| SCHEMBL24916784 | 0.77 | CA2 (0.46) | CYP2D6THRBHSD17B10CA12CA1 | |
| SCHEMBL8612926 | 0.75 | MTNR1A (0.32) | — | |
| SCHEMBL7407325 | 0.75 | LGALS8 (0.34) | HSD17B10TSHR | |
| SCHEMBL6438566 | 0.74 | MGAM (0.30) | — | |
| SCHEMBL10030521 | 0.71 | CA12 (0.46) | CYP2D6THRBHSD17B10CA12CA1 | |
| SCHEMBL13064880 | 0.71 | CA12 (0.46) | CYP2D6THRBHSD17B10CA12CA1 | |
| SCHEMBL9999675 | 0.71 | CA12 (0.46) | CYP2D6THRBHSD17B10CA12CA1 | |
| SCHEMBL10063962 | 0.71 | CA12 (0.46) | CYP2D6THRBHSD17B10CA12CA1 | |
| SCHEMBL9290126 | 0.71 | CA12 (0.46) | CYP2D6THRBHSD17B10CA12CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0580812-A1 | ANTI-TUMOR AND ANTI-PSORIATIC AGENTS | SCHERING CORPORATION (US) | 1994-02-02 | — | — | EP | disclosed |
| WO-1992018507-A1 | ANTI-TUMOR AND ANTI-PSORIATIC AGENTS | SCHERING CORPORATION (US) | 1992-10-29 | — | — | WO | disclosed |
| EP-0508792-A1 | Anti-tumor and anti-psoriatic agents | SCHERING CORPORATION (US) | 1992-10-14 | — | — | EP | disclosed |