Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | PKM | P14618 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.52 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14364287 | 0.94 | MAPT (0.60) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL563763 | 0.91 | PKM (0.67) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL8147273 | 0.91 | MAPT (0.65) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL8107611 | 0.87 | MAPT (0.60) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL13056646 | 0.85 | KMT2A (0.61) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL12613696 | 0.85 | ALDH1A1 (0.54) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL10622798 | 0.85 | KAT2B (0.72) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL111519 | 0.85 | PRSS1 (0.55) | ALDH1A1MAPTKDM4EPOLBPKM | |
| SCHEMBL8645160 | 0.85 | ALDH1A1 (0.57) | ALDH1A1MAPTPOLBPKMSMN1; SMN2 | |
| SCHEMBL14294847 | 0.85 | MAPT (0.69) | ALDH1A1MAPTKDM4EPOLBPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |