Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 2/20 | 0.47 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.47 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.47 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 4/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | NSD2 | O96028 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL6369766 | 0.95 | ABCC9 (0.50) | ABCC9ABCC8KCNJ11KCNJ8PGR | |
| SCHEMBL9587437 | 0.83 | ABCC9 (0.38) | ABCC9ABCC8KCNJ11KCNJ8GABRA1 | |
| SCHEMBL9588407 | 0.81 | CA1 (0.39) | F10CA1CA2 | |
| SCHEMBL9589614 | 0.80 | ABCC9 (0.38) | ABCC9ABCC8KCNJ11KCNJ8PGR | |
| SCHEMBL9587666 | 0.79 | GABRA1 (0.37) | ABCC9ABCC8KCNJ11KCNJ8GABRA1 | |
| SCHEMBL9733561 | 0.79 | PGR (0.36) | ABCC9ABCC8KCNJ11KCNJ8PGR | |
| Bimakalim SCHEMBL231904 | 0.79 | PDE4A (0.43) | ABCC9ABCC8KCNJ11KCNJ8CASP3 | |
| SCHEMBL9733284 | 0.79 | HTR1A (0.37) | ABCC9ABCC8KCNJ11KCNJ8PGR | |
| SCHEMBL8088443 | 0.79 | MAOB (0.38) | ABCC9ABCC8KCNJ11KCNJ8PGR | |
| SCHEMBL9587505 | 0.78 | SLC6A9 (0.33) | PGRF10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5272170-A | Tetralones with pharmacological activity | J. URIACH & CIA., S.A. (ES) | 1993-12-21 | — | — | US | disclosed |
| US-5208246-A | Hypotensive, bronchodilator | J. URIACH & CIA. (ES) | 1993-05-04 | — | — | US | disclosed |
| EP-0489300-A2 | Tetralones with pharmacological activity | J. URIACH & CIA. S.A. (ES) | 1992-06-10 | — | — | EP | disclosed |