Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4398354 | 0.88 | ALDH1A1 (0.43) | ALDH1A1POLBL3MBTL1SMN1; SMN2GAA | |
| SCHEMBL4398352 | 0.88 | ALDH1A1 (0.43) | ALDH1A1POLBL3MBTL1SMN1; SMN2GAA | |
| SCHEMBL4399822 | 0.82 | ALDH1A1 (0.47) | ALDH1A1ALOX12MITFHTTL3MBTL1 | |
| SCHEMBL4398585 | 0.82 | ALDH1A1 (0.47) | ALDH1A1POLBHTTL3MBTL1SMN1; SMN2 | |
| SCHEMBL4393320 | 0.82 | ALDH1A1 (0.47) | ALDH1A1POLBHTTL3MBTL1SMN1; SMN2 | |
| SCHEMBL4393412 | 0.82 | ALDH1A1 (0.47) | ALDH1A1ALOX12MITFHTTL3MBTL1 | |
| SCHEMBL5031707 | 0.80 | ALDH1A1 (0.44) | ALDH1A1POLBHTTL3MBTL1SMN1; SMN2 | |
| SCHEMBL5027083 | 0.78 | MAPK1 (0.47) | ALDH1A1POLBL3MBTL1SMN1; SMN2GAA | |
| SCHEMBL4396060 | 0.77 | CCR6 (0.51) | ALDH1A1POLBHTTL3MBTL1CYP1A2 | |
| SCHEMBL5451660 | 0.75 | ALDH1A1 (0.68) | ALDH1A1ALOX12HTTL3MBTL1CYP1A2 |
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-2007393-A2 | THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS | Board Of Supervisors Of Louisiana State University And Agricultural And Mechanical College (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007118149-A2 | THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL LOLLEGE (US) | 2007-10-18 | — | — | WO | disclosed |