Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.62 |
| ▸ | HTT | P42858 | 4/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CDC7 | O00311 | 1/20 | 0.48 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL16597702 | 0.90 | ALDH1A1 (0.50) | ALDH1A1HTTNPSR1SMN1; SMN2TDP1 | |
| SCHEMBL16075307 | 0.85 | CKS1B (0.49) | ALDH1A1HTTNPSR1HPGDGAA | |
| SCHEMBL19909712 | 0.84 | ALDH1A1 (0.65) | ALDH1A1HTTNPSR1SMN1; SMN2TDP1 | |
| SCHEMBL19909686 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HTTNPSR1SMN1; SMN2TDP1 | |
| SCHEMBL4086525 | 0.82 | DHODH (0.59) | ALDH1A1HTTNPSR1SMN1; SMN2TDP1 | |
| SCHEMBL16075321 | 0.81 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1SMN1; SMN2TDP1 | |
| SCHEMBL16075310 | 0.81 | ALDH1A1 (0.44) | ALDH1A1HTTNPSR1HPGDGAA | |
| SCHEMBL16075312 | 0.81 | BTK (0.49) | ALDH1A1HTTNPSR1GAAHSD17B10 | |
| SCHEMBL1919885 | 0.80 | ALDH1A1 (0.61) | ALDH1A1HPGDHSD17B10MEN1KMT2A | |
| SCHEMBL16127654 | 0.80 | BTK (0.41) | ALDH1A1HTTNPSR1SMN1; SMN2MAPT |
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-2970163-B1 | 5-THIAZOLECARBOXAMIDE DERVATIVES AND THEIR USE AS BTK INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2018-02-28 | — | — | EP | disclosed |