Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.40 |
| ▸ | IKBKB | O14920 | 2/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | GAK | O14976 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5728057 | 0.90 | GABRA5 (0.38) | CHEK1GAKHDAC3HDAC1HDAC2 | |
| SCHEMBL5727993 | 0.87 | CHEK1 (0.39) | CHEK1GAKJAK2MAPK14CSNK1D | |
| SCHEMBL5435719 | 0.83 | IKBKB (0.46) | CHEK1IKBKBJAK1JAK3JAK2 | |
| SCHEMBL5728485 | 0.77 | ALDH1A1 (0.41) | CHEK1MEN1KMT2ATDP1CNR2 | |
| SCHEMBL5727473 | 0.73 | CNR1 (0.34) | IKBKBMEN1KMT2AHDAC3HDAC1 | |
| SCHEMBL6112105 | 0.73 | ALDH1A1 (0.37) | GAKMEN1KMT2AHDAC6HDAC3 | |
| SCHEMBL5728244 | 0.73 | IKBKB (0.56) | IKBKBJAK2MEN1EIF2AK2KMT2A | |
| SCHEMBL5728217 | 0.73 | IKBKB (0.42) | IKBKBJAK2MEN1EIF2AK2KMT2A | |
| SCHEMBL5430675 | 0.72 | CHEK1 (0.42) | CHEK1IKBKBGAKMEN1KMT2A | |
| SCHEMBL2874583 | 0.72 | CHEK1 (0.46) | CHEK1IKBKBMEN1KMT2AHDAC3 |
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-1694665-A2 | SUBSTITUTED THIOPHENES | AiCuris GmbH & Co. KG (DE) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005063734-A2 | SUBSTITUTED THIOPHENES | AICURIS GMBH & CO. KG (DE) | 2005-07-14 | — | — | WO | disclosed |