Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 1/20 | 0.58 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.57 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.53 |
| ▸ | IKBKB | O14920 | 2/20 | 0.52 |
| ▸ | CHUK | O15111 | 2/20 | 0.52 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.50 |
| ▸ | FYN | P06241 | 3/20 | 0.48 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.48 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.47 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.47 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.47 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.47 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 1/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.44 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.44 |
| ▸ | EIF2S1 | P05198 | 1/20 | 0.44 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18617182 | 0.85 | CHEK2 (0.64) | PIK3CBMAP4K4CHEK2FYNMKNK1 | |
| SCHEMBL18615835 | 0.85 | CHEK2 (0.64) | PIK3CBMAP4K4IKBKBCHUKCHEK2 | |
| SCHEMBL18615844 | 0.84 | PIK3CB (0.67) | PIK3CBMAP4K4CHRNA7CHEK2FYN | |
| SCHEMBL18615848 | 0.83 | MKNK1 (0.61) | PIK3CBMAP4K4IKBKBCHUKCHEK2 | |
| SCHEMBL18615823 | 0.83 | MAP4K4 (0.60) | PIK3CBMAP4K4IKBKBCHEK2FYN | |
| SCHEMBL18616649 | 0.83 | MAP4K4 (0.62) | PIK3CBMAP4K4CHEK2FYNMKNK1 | |
| SCHEMBL18616283 | 0.82 | PIK3CB (0.68) | PIK3CBIKBKBCHUKCHEK2IKBKE | |
| SCHEMBL18616712 | 0.81 | PIK3CB (0.56) | PIK3CBMAP4K4CHRNA7IKBKBCHEK2 | |
| SCHEMBL18617207 | 0.80 | PIK3CB (0.58) | PIK3CBMAP4K4CHRNA7IKBKBCHEK2 | |
| SCHEMBL18616321 | 0.80 | PIK3CB (0.58) | PIK3CBMAP4K4CHRNA7CHEK2FYN |
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-3344613-B1 | HETEROARYL COMPOUNDS AND THEIR USE AS THERAPEUTIC DRUGS | DONG A SOCIO HOLDINGS CO LTD (KR) | 2020-03-04 | — | — | EP | disclosed |