Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD51 | Q06609 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1810783 | 0.80 | RAPGEF4 (0.38) | RAD51HDAC8CA1CA2CA9 | |
| SCHEMBL10638597 | 0.72 | LMNA (0.52) | LMNATDP1RAPGEF4ALDH1A1GAA | |
| SCHEMBL12346382 | 0.72 | — | — | |
| SCHEMBL29983014 | 0.67 | HDAC8 (0.46) | RAD51HDAC8CA1CA2CA9 | |
| SCHEMBL5831908 | 0.64 | HDAC8 (0.58) | HDAC8CA1CA2CA9CA12 | |
| SCHEMBL1823536 | 0.63 | RAPGEF4 (0.49) | CA1CA2CA9CA12LMNA | |
| SCHEMBL30725489 | 0.62 | CYP3A4 (0.46) | LMNATDP1RAPGEF4BRD4ALDH1A1 | |
| SCHEMBL176615 | 0.62 | CYP3A4 (0.46) | LMNATDP1RAPGEF4BRD4ALDH1A1 | |
| SCHEMBL14925398 | 0.62 | PDIA6 (0.47) | RAD51CA1CA2CA9CA12 | |
| SCHEMBL29212129 | 0.61 | CYP2A6 (0.41) | HDAC8CA1CA2ALDH1A1CYP2A6 |
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-2493895-B1 | N-CONTAINING HETEROARYL DERIVATIVES AS JAK3 KINASE INHIBITORS | VECTURA LTD (GB) | 2017-04-26 | — | — | EP | disclosed |