Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9935086 | 0.86 | TAAR1 (0.52) | MEN1KMT2ALMNATAAR1PTPN1 | |
| Hydrochloric Acid SCHEMBL696798 | 0.85 | TAAR1 (0.51) | MEN1KMT2ALMNATAAR1PTPN1 | |
| SCHEMBL17540637 | 0.78 | KMT2A (0.44) | MEN1KMT2ALMNA | |
| SCHEMBL17540639 | 0.78 | SPR (0.46) | MEN1KMT2ALMNATAAR1 | |
| SCHEMBL9925289 | 0.76 | HPGD (0.51) | MEN1KMT2ALMNACA1CA2 | |
| SCHEMBL19468009 | 0.75 | HDAC3 (0.52) | MEN1KMT2ALMNATAAR1 | |
| Hydrochloric Acid SCHEMBL19468148 | 0.74 | HDAC3 (0.51) | MEN1KMT2ALMNATAAR1 | |
| SCHEMBL166076 | 0.74 | ACACB (0.56) | — | |
| SCHEMBL1291594 | 0.73 | HPGD (0.50) | MEN1KMT2ATAAR1 | |
| SCHEMBL15356006 | 0.73 | TAAR1 (0.49) | MEN1KMT2ALMNATAAR1PTPN1 |
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-9944635-B2 | Deuterated pyrazino[2,1-a]isoquinoline compounds and methods of treatment using the same | CONCERT PHARMACEUTICALS, INC. (US) | 2018-04-17 | — | — | US | disclosed |