Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL2349519 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL29658645 | 0.74 | GLA (0.52) | GLATSHRALDH1A1LMNAKMT2A | |
| SCHEMBL25131028 | 0.71 | TSHR (0.57) | GLATSHRALDH1A1HSD17B10NPSR1 | |
| SCHEMBL20848303 | 0.71 | GLA (0.48) | GLATSHRALDH1A1KMT2AHSD17B10 | |
| SCHEMBL723522 | 0.68 | GLA (0.73) | GLATSHRALDH1A1 | |
| SCHEMBL16852654 | 0.68 | GLA (0.61) | GLATSHRALDH1A1LMNAKMT2A | |
| SCHEMBL25788948 | 0.67 | CYP1A2 (0.30) | — | |
| SCHEMBL16750124 | 0.66 | TSHR (0.50) | GLATSHRALDH1A1LMNAKMT2A | |
| SCHEMBL24417341 | 0.64 | GLA (0.55) | GLATSHRALDH1A1LMNAKMT2A | |
| SCHEMBL523944 | 0.63 | — | — |
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-1483228-B1 | NK1 ANTAGONISTS | SCHERING CORP (US) | 2010-06-02 | — | — | EP | disclosed |