Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 1/20 | 0.58 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.58 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.58 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.58 |
| ▸ | PLK1 | P53350 | 8/20 | 0.43 |
| ▸ | GSK3A | P49840 | 3/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.43 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | CSNK1G3 | Q9Y6M4 | 2/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | PLK4 | O00444 | 2/20 | 0.42 |
| ▸ | DAPK3 | O43293 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7887074 | 0.85 | ABCC9 (0.71) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7895748 | 0.85 | ABCC9 (0.61) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7895113 | 0.84 | ABCC9 (0.60) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7895591 | 0.84 | ABCC9 (0.60) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL8670505 | 0.82 | ABCC9 (0.70) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL8670509 | 0.82 | ABCC9 (0.70) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7886866 | 0.78 | ABCC9 (0.58) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7886860 | 0.78 | ABCC9 (0.58) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7894022 | 0.78 | ABCC9 (0.58) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7894099 | 0.76 | ABCC9 (0.50) | ABCC9ABCC8KCNJ11KCNJ8GSK3A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1151990-A1 | Substituted N-arylmethylamino derivatives of cyclobutene-3, 4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-11-07 | — | — | EP | claimed |
| US-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | claimed |
| EP-1151990-A1 | Substituted N-arylmethylamino derivatives of cyclobutene-3, 4-diones | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-11-07 | — | — | EP | disclosed |
| US-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | disclosed |