Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 5/20 | 0.42 |
| ▸ | CDC7 | O00311 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22655800 | 1.00 | MKNK1 (0.42) | MKNK1CDC7KDRGRM4TRPA1 | |
| SCHEMBL22655893 | 0.82 | CDC7 (0.53) | MKNK1CDC7KDRTRPA1TRPM8 | |
| SCHEMBL31085390 | 0.82 | CDC7 (0.53) | MKNK1CDC7KDRTRPA1TRPM8 | |
| SCHEMBL22749728 | 0.77 | KDR (0.65) | MKNK1CDC7KDRROCK2 | |
| SCHEMBL15638572 | 0.70 | SYK (0.48) | MKNK1KDRROCK2DYRK1AMAPK1 | |
| SCHEMBL28200962 | 0.69 | DYRK1A (0.53) | CDC7KDRROCK2DYRK1AMAPK1 | |
| SCHEMBL14312467 | 0.68 | NOS1 (0.50) | TRPA1TRPM8TRPV1ROCK2NOS1 | |
| SCHEMBL3590783 | 0.67 | NOS1 (0.57) | TRPA1TRPM8TRPV1ROCK2IDO1 | |
| SCHEMBL20385536 | 0.67 | MKNK1 (0.51) | MKNK1TRPA1 | |
| SCHEMBL30932752 | 0.67 | AXL (0.39) | MKNK1CDC7TRPA1TRPM8TRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114096542-B | Condensed tricyclic pyrroles as alpha-1 antitrypsin modulators | 弗特克斯药品有限公司 | 2024-09-10 | — | — | CN | disclosed |
| EP-3969440-A1 | CONDENSED TRICYCLIC PYRROLES AS ALPHA-1 ANTITRYPSIN MODULATORS | Vertex Pharmaceuticals Incorporated (US) | 2022-03-23 | — | — | EP | disclosed |