Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.73 |
| ▸ | NPC1 | O15118 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 4/20 | 0.68 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | TP53 | P04637 | 3/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | HPGD | P15428 | 4/20 | 0.57 |
| ▸ | F2 | P00734 | 1/20 | 0.57 |
| ▸ | XBP1 | P17861 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HPN | P05981 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29456973 | 0.89 | ELANE (0.93) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL125184 | 0.89 | ELANE (0.93) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL3254378 | 0.87 | ELANE (0.89) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL12212888 | 0.87 | ELANE (0.89) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL23668740 | 0.87 | ELANE (0.71) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL273036 | 0.85 | ELANE (0.93) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL29382161 | 0.85 | ELANE (1.00) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL272702 | 0.85 | ELANE (1.00) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL693099 | 0.84 | ELANE (0.67) | ELANENPC1RAB9ARXFP1ALDH1A1 | |
| SCHEMBL692236 | 0.82 | HPN (0.76) | ELANENPC1RAB9ARXFP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1670749-A1 | 2-SUBSTITUTED BENZOIC ACID DERIVATIVES AS HM74A RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005016870-A1 | 2-SUBSTITUTED BENZOIC ACID DERIVATIVES AS HM74A RECEPTOR AGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |