Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 15/20 | 0.47 |
| ▸ | CA1 | P00915 | 14/20 | 0.47 |
| ▸ | CA12 | O43570 | 12/20 | 0.44 |
| ▸ | CA9 | Q16790 | 8/20 | 0.44 |
| ▸ | CA6 | P23280 | 5/20 | 0.44 |
| ▸ | CA7 | P43166 | 5/20 | 0.44 |
| ▸ | CA13 | Q8N1Q1 | 5/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7144040 | 0.83 | CA1 (0.55) | CA2CA1CA12CA9CA6 | |
| SCHEMBL30512097 | 0.83 | CA1 (0.55) | CA2CA1CA12CA9CA6 | |
| SCHEMBL30512098 | 0.83 | CA1 (0.55) | CA2CA1CA12CA9CA6 | |
| SCHEMBL2300229 | 0.74 | CA1 (0.70) | CA2CA1CA12CA9CA4 | |
| SCHEMBL14973217 | 0.73 | CA2 (0.52) | CA2CA1CA12CA9CA6 | |
| SCHEMBL8557285 | 0.72 | CES2 (0.55) | — | |
| SCHEMBL15716218 | 0.72 | KDM4E (0.44) | — | |
| SCHEMBL8552972 | 0.72 | HPGD (0.47) | — | |
| SCHEMBL3347957 | 0.72 | CA2 (0.63) | CA2CA1CA12CA9CA6 | |
| SCHEMBL3844535 | 0.71 | CA1 (0.53) | CA2CA1CA12CA9CA6 |
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-0861245-A1 | PIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1998-09-02 | — | — | EP | disclosed |
| WO-1997019073-A1 | PIPERIDINE AND TETRAHYDROPYRIDINE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1997-05-29 | — | — | WO | disclosed |