Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | HPGD | P15428 | 7/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5728734 | 0.99 | ALDH1A1 (0.47) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL5730991 | 0.97 | HPGD (0.47) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL5444405 | 0.82 | ALDH1A1 (0.65) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL5727727 | 0.82 | HPGD (0.53) | ALDH1A1HPGDLMNAKDM4ETP53 | |
| SCHEMBL5434339 | 0.81 | ALDH1A1 (0.66) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL5728485 | 0.80 | ALDH1A1 (0.41) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL5432089 | 0.79 | ALDH1A1 (0.66) | ALDH1A1HPGDLMNAKDM4ETP53 | |
| SCHEMBL5728267 | 0.75 | ALDH1A1 (0.64) | ALDH1A1HPGDLMNAKDM4EMAPT | |
| SCHEMBL14505487 | 0.72 | ALDH1A1 (0.62) | CHEK1ALDH1A1HPGDLMNAKDM4E | |
| SCHEMBL14505518 | 0.69 | HPGD (0.60) | ALDH1A1HPGDLMNAKDM4ETP53 |
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 |