Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 1/20 | 0.39 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.39 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.39 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 3/20 | 0.31 |
| ▸ | HAT1 | O14929 | 1/20 | 0.31 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4261013 | 0.85 | P2RX7 (0.43) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL7898359 | 0.76 | P2RX7 (0.44) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL8619928 | 0.76 | ABCC9 (0.37) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL4263948 | 0.75 | P2RX7 (0.45) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL7893927 | 0.73 | HTT (0.38) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL4261010 | 0.72 | ABCC9 (0.40) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL7887079 | 0.71 | HTT (0.36) | ABCC9ABCC8KCNJ11KCNJ8P2RX7 | |
| SCHEMBL7894054 | 0.71 | ALDH1A1 (0.33) | ABCC9ABCC8KCNJ11KCNJ8PLK1 | |
| SCHEMBL7596888 | 0.71 | ROCK2 (0.47) | P2RX7HDAC1TSHRALDH1A1HTT | |
| SCHEMBL7886987 | 0.69 | P2RX7 (0.39) | P2RX7HSD17B10ALDH1A1NPSR1MAPT |
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-5780505-A | ADMINISTERING AS SMOOTH MUSCLE RELAXANT | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-07-14 | — | — | US | disclosed |