Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.32 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | UBE2N | P61088 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2409950 | 0.92 | HTR6 (0.38) | ALDH1A1KAT8HTR2CSLC6A4KAT6A | |
| SCHEMBL31187457 | 0.90 | KAT8 (0.35) | KAT8PKMHTR2CSLC6A4KAT6A | |
| SCHEMBL2415723 | 0.90 | HTR2C (0.39) | KAT8HTR2CSLC6A4KAT6AKAT5 | |
| SCHEMBL31187449 | 0.89 | MET (0.42) | ALDH1A1CHRM5PKMTSHR | |
| SCHEMBL4418624 | 0.88 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2CHRM5GAAHTT | |
| SCHEMBL1278111 | 0.88 | RIPK1 (0.34) | ALDH1A1SMN1; SMN2KAT8GAAPKM | |
| SCHEMBL2412876 | 0.88 | PTGDR2 (0.39) | KAT8GAAHTR2CSLC6A4KAT6A | |
| SCHEMBL2414740 | 0.88 | HTR2C (0.37) | KAT8NPSR1PKMHTR2CSLC6A4 | |
| SCHEMBL2414119 | 0.87 | RORC (0.37) | KAT8KAT6AKAT5 | |
| SCHEMBL2412420 | 0.86 | GRM4 (0.38) | KAT8HTR2CSLC6A4KAT6AKAT5 |
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-2364979-A1 | Pyrrole compounds | Takeda Pharmaceutical Company Limited (JP) | 2011-09-14 | — | — | EP | disclosed |