Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16167292 | 0.90 | LMNA (0.54) | LMNAMEN1ALDH1A1HTTKMT2A | |
| SCHEMBL4785593 | 0.87 | TSHR (0.52) | MEN1ALDH1A1HTTKMT2ATSHR | |
| SCHEMBL6682020 | 0.84 | CYP1A2 (0.48) | TSHRPOLB | |
| SCHEMBL28519833 | 0.84 | MEN1 (0.40) | LMNAMEN1KMT2APKMTSHR | |
| SCHEMBL19090603 | 0.83 | SIGMAR1 (0.50) | MEN1KMT2A | |
| SCHEMBL108633 | 0.83 | LMNA (0.54) | LMNAAOC3PKM | |
| SCHEMBL167715 | 0.83 | AOC3 (0.55) | LMNAMEN1ALDH1A1HTTKMT2A | |
| SCHEMBL6682257 | 0.82 | SIGMAR1 (0.50) | TSHR | |
| SCHEMBL8508282 | 0.82 | LMNA (0.48) | LMNAMEN1ALDH1A1KMT2ABLM | |
| Hydrochloric Acid SCHEMBL30514257 | 0.81 | LMNA (0.53) | LMNAMEN1KMT2AAOC3PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1731587-B1 | Process for the preparation of tolanes | MERCK PATENT GMBH (DE) | 2013-01-23 | — | — | EP | disclosed |
| EP-1731587-A1 | Tolanes, process for their preparation and use thereof | MERCK PATENT GmbH (DE) | 2006-12-13 | — | — | EP | disclosed |