Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7235114 | 0.85 | ALDH1A1 (0.43) | ALDH1A1HTTTSHRMAPTPKM | |
| SCHEMBL7235111 | 0.85 | ALDH1A1 (0.43) | ALDH1A1HTTTSHRMAPTPKM | |
| SCHEMBL13118438 | 0.82 | MAPT (0.44) | ALDH1A1TSHRMAPTPKMATM | |
| SCHEMBL4181616 | 0.77 | ALDH1A1 (0.39) | ALDH1A1HTTTSHRMAPTSMN1; SMN2 | |
| SCHEMBL7849672 | 0.74 | POLB (0.46) | ALDH1A1HTTMAPTPKMATM | |
| SCHEMBL1939080 | 0.73 | NPC1 (0.48) | ALDH1A1HTTTSHRMAPTPKM | |
| SCHEMBL1939079 | 0.73 | NPC1 (0.48) | ALDH1A1HTTTSHRMAPTPKM | |
| SCHEMBL2920208 | 0.73 | POLB (0.45) | ALDH1A1TSHRMAPTPKMATM | |
| SCHEMBL6646855 | 0.71 | GAA (0.63) | MAPTPKMATMPOLBSMN1; SMN2 | |
| SCHEMBL4167131 | 0.71 | ALDH1A1 (0.49) | ALDH1A1HTTTSHRMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7276519-B2 | Thieno[3,2-b]pyridine-6-carbonitriles and thieno[2,3-b]pyridine-5-carbonitriles as protein kinase inhibitors | WYETH (US) | 2007-10-02 | — | — | US | disclosed |