Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.57 |
| ▸ | KLK7 | P49862 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | UCHL1 | P09936 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL15349958 | 1.00 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2EPHX2KLK7MAPK1 | |
| SCHEMBL7429992 | 0.90 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2EPHX2KLK7MAPK1 | |
| SCHEMBL22703436 | 0.89 | NPSR1 (0.57) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL13246364 | 0.89 | NPSR1 (0.57) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL16314626 | 0.88 | EPHX2 (0.53) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL29485654 | 0.87 | EPHX2 (0.52) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL29485661 | 0.85 | EPHX2 (0.51) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL30184991 | 0.85 | EPHX2 (0.51) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E | |
| SCHEMBL29485679 | 0.84 | NPC1 (0.55) | ALDH1A1SMN1; SMN2EPHX2KLK7MAPK1 | |
| SCHEMBL7359670 | 0.84 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2EPHX2KLK7KDM4E |
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-4886813-A | INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1989-12-12 | — | — | US | disclosed |