Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 4/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
| ▸ | LPL | P06858 | 1/20 | 0.30 |
| ▸ | LIPG | Q9Y5X9 | 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 | |
|---|---|---|---|---|
| SCHEMBL19931317 | 0.82 | HSPB1 (0.37) | HSPB1BRD4PTGS2EPAS1LPL | |
| SCHEMBL21190879 | 0.79 | BRD4 (0.47) | HSPB1BRD4PTGS2EPAS1SCN9A | |
| SCHEMBL21904915 | 0.76 | HSPB1 (0.39) | HSPB1BRD4PTGS2LPLLIPG | |
| SCHEMBL29533045 | 0.75 | HSPB1 (0.39) | HSPB1BRD4PTGS2LPLLIPG | |
| SCHEMBL15069672 | 0.75 | HSPB1 (0.39) | HSPB1BRD4PTGS2LPLLIPG | |
| SCHEMBL20155120 | 0.74 | ALDH1A1 (0.40) | HSPB1BRD4PTGS2LPLLIPG | |
| SCHEMBL20155140 | 0.73 | PTGS2 (0.51) | HSPB1BRD4PTGS2EPAS1 | |
| SCHEMBL20268765 | 0.73 | HSPB1 (0.63) | HSPB1PTGS2 | |
| SCHEMBL31073743 | 0.73 | HSPB1 (0.38) | HSPB1BRD4PTGS2EPAS1LPL | |
| SCHEMBL16651407 | 0.72 | BRD4 (0.47) | HSPB1BRD4PTGS2EPAS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019141131-A1 | BROMODOMAIN INHIBITOR COMPOUND AND USE THEREOF | 中国科学院上海药物研究所 | 2019-07-25 | — | — | WO | disclosed |
| US-9359548-B2 | Organic electroluminescent device | UDC IRELAND LIMITED (IE) | 2016-06-07 | — | — | US | disclosed |