Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5027083 | 0.85 | MAPK1 (0.47) | ALDH1A1MGLLLMNAL3MBTL1MAPT | |
| SCHEMBL4398352 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MGLLLMNAL3MBTL1MAPT | |
| SCHEMBL4398354 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MGLLLMNAL3MBTL1MAPT | |
| SCHEMBL5028982 | 0.80 | ALDH1A1 (0.47) | ALDH1A1LMNAL3MBTL1POLBTDP1 | |
| SCHEMBL5028967 | 0.79 | ALDH1A1 (0.49) | ALDH1A1LMNAL3MBTL1MAPTPOLB | |
| SCHEMBL4393306 | 0.76 | GLA (0.50) | ALDH1A1MGLLGLACACNA1BAPBA1 | |
| SCHEMBL8325341 | 0.68 | ALDH1A1 (0.45) | ALDH1A1LMNAMAPTPOLBKMT2A | |
| SCHEMBL10866850 | 0.67 | ALDH1A1 (0.66) | ALDH1A1LMNAL3MBTL1MAPTPOLB | |
| SCHEMBL2727273 | 0.66 | LMNA (0.50) | ALDH1A1MGLLLMNACHRM2HTR1A | |
| SCHEMBL4398332 | 0.66 | EHMT2 (0.36) | ALDH1A1MGLLLMNAHTR1AADRA2A |
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 |