Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC40A1 | Q9NP59 | 5/20 | 0.59 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.51 |
| ▸ | CKS1B | P61024 | 2/20 | 0.51 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | PTGES2 | Q9H7Z7 | 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 | |
|---|---|---|---|---|
| SCHEMBL30102910 | 0.81 | ALDH1A1 (0.74) | ALDH1A1KEAP1LMNATSHRMEN1 | |
| SCHEMBL1116405 | 0.81 | ALDH1A1 (0.74) | ALDH1A1KEAP1LMNATSHRMEN1 | |
| SCHEMBL8713663 | 0.81 | KEAP1 (0.58) | SLC40A1GLO1ALDH1A1KEAP1LMNA | |
| SCHEMBL14960618 | 0.79 | SLC40A1 (0.52) | SLC40A1GLO1ALDH1A1PTGS1PTGS2 | |
| SCHEMBL15870072 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KEAP1LMNATSHRMEN1 | |
| SCHEMBL784141 | 0.77 | KEAP1 (0.66) | SLC40A1GLO1ALDH1A1KEAP1TP53 | |
| SCHEMBL17813852 | 0.77 | SLC40A1 (0.48) | SLC40A1GLO1ALDH1A1KEAP1TP53 | |
| SCHEMBL11997129 | 0.76 | SLC40A1 (0.79) | SLC40A1GLO1TDP1MEN1KMT2A | |
| SCHEMBL5015931 | 0.76 | KEAP1 (0.68) | SLC40A1ALDH1A1KEAP1LMNAMEN1 | |
| SCHEMBL2119624 | 0.76 | SLC40A1 (0.47) | SLC40A1GLO1ALDH1A1LMNAKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |