Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.39 |
| ▸ | CA1 | P00915 | 7/20 | 0.39 |
| ▸ | CA2 | P00918 | 7/20 | 0.39 |
| ▸ | CA9 | Q16790 | 7/20 | 0.39 |
| ▸ | CA7 | P43166 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 3/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL419937 | 0.84 | THRB (0.41) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL4131884 | 0.82 | ALDH1A1 (0.47) | CA12CA1CA2CA9CA7 | |
| SCHEMBL4866300 | 0.80 | CA12 (0.41) | CA12CA1CA2CA9CA7 | |
| SCHEMBL720020 | 0.79 | DRD2 (0.48) | MEN1HTTKMT2AL3MBTL1 | |
| SCHEMBL11788154 | 0.79 | SMN1; SMN2 (0.47) | CA12CA1CA2CA9CA7 | |
| SCHEMBL4868644 | 0.79 | TDP1 (0.46) | CA12CA1CA2CA9CA7 | |
| SCHEMBL4355604 | 0.79 | CA12 (0.42) | CA12CA1CA2CA9CA7 | |
| SCHEMBL939924 | 0.79 | CA12 (0.42) | CA12CA1CA2CA9CA7 | |
| SCHEMBL1506206 | 0.79 | LTA4H (0.44) | TSHRCHRNB4CHRNA3CHRNA7CHRNB2 | |
| SCHEMBL1506385 | 0.79 | CYP3A4 (0.41) | CHRNB4CHRNA3CHRNA7CHRNB2CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2384457-B1 | COATING COMPOSITIONS | MERCK PATENT GMBH (DE) | 2022-07-06 | — | — | EP | disclosed |