Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 5/20 | 0.58 |
| ▸ | LIMK1 | P53667 | 4/20 | 0.51 |
| ▸ | STING1 | Q86WV6 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7218005 | 0.87 | KDM4E (0.60) | IKBKBSTING1ALDH1A1KDM4EGAA | |
| SCHEMBL9434017 | 0.81 | STING1 (0.46) | IKBKBLIMK1STING1ALDH1A1GAA | |
| SCHEMBL3828423 | 0.80 | IKBKB (0.56) | IKBKBLIMK1ALDH1A1KDM4EGAA | |
| SCHEMBL20509578 | 0.76 | LIMK1 (0.56) | IKBKBLIMK1STING1ALDH1A1KDM4E | |
| SCHEMBL5106264 | 0.76 | IKBKB (0.58) | IKBKBLIMK1ALDH1A1KDM4EGAA | |
| SCHEMBL19769187 | 0.75 | IKBKB (0.48) | IKBKBLIMK1ALDH1A1KDM4EGAA | |
| SCHEMBL5118198 | 0.75 | IKBKB (0.57) | IKBKBLIMK1ALDH1A1KDM4EGAA | |
| SCHEMBL26049804 | 0.74 | EDNRA (0.50) | STING1ALDH1A1KDM4EGAAHPGD | |
| SCHEMBL4658241 | 0.74 | IKBKB (1.00) | IKBKBLIMK1ALDH1A1KDM4EHPGD | |
| SCHEMBL11101251 | 0.73 | BACE1 (0.54) | ALDH1A1KDM4EGAAHPGDHSD17B10 |
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-5350748-A | 3-thio or amino substituted-benzo[b]thiophene-2-carboxamides and 3-oxygen, thio, or amino substituted-benzofuran-2-carboxamides as inhibitors of cell adhesion | WARNER-LAMBERT COMPANY (US) | 1994-09-27 | — | — | US | disclosed |