Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10313767 | 0.66 | TSHR (0.34) | ALDH1A1CYP3A4 | |
| SCHEMBL14878798 | 0.66 | GPR35 (0.33) | KMT2AALDH1A1 | |
| SCHEMBL10957637 | 0.62 | — | — | |
| SCHEMBL16309275 | 0.62 | GPR35 (0.55) | KMT2AALDH1A1MAPK1MAPT | |
| SCHEMBL17465776 | 0.62 | THRB (0.31) | — | |
| SCHEMBL16701997 | 0.62 | TDP1 (0.34) | ALDH1A1MAPTCYP3A4 | |
| SCHEMBL43494 | 0.60 | CYP2C19 (0.57) | KMT2AALDH1A1MAPK1MAPT | |
| SCHEMBL48947 | 0.60 | TSHR (0.59) | KMT2AALDH1A1 | |
| SCHEMBL31514653 | 0.60 | SNCA (0.44) | KMT2AALDH1A1MAPK1MAPT | |
| SCHEMBL989411 | 0.59 | — | — |
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-2788359-B1 | COMPOSITION AND METHOD FOR NEUROPEPTIDE S RECEPTOR (NPSR) ANTAGONISTS | RES TRIANGLE INST (US) | 2017-03-01 | — | — | EP | disclosed |