Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 7/20 | 0.41 |
| ▸ | DRD3 | P35462 | 7/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.38 |
| ▸ | ABCC9 | O60706 | 3/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNG | P07510 | 1/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9585693 | 0.91 | DRD2 (0.40) | MAP3K14DRD2DRD3HCRTR2CYP2D6 | |
| SCHEMBL4140398 | 0.87 | MAP3K14 (0.59) | MAP3K14DRD2DRD3CHRNA1CHRNG | |
| SCHEMBL4133966 | 0.87 | MAP3K14 (0.59) | MAP3K14DRD2DRD3CHRNA1CHRNG | |
| SCHEMBL29243618 | 0.82 | DRD2 (0.42) | DRD2DRD3HCRTR2ABCB1CHRNA1 | |
| SCHEMBL1266045 | 0.82 | DRD2 (0.42) | DRD2DRD3HCRTR2ABCB1CHRNA1 | |
| SCHEMBL9585392 | 0.82 | DRD2 (0.38) | DRD2DRD3HCRTR2CYP2D6KDM4E | |
| SCHEMBL9585396 | 0.82 | DRD2 (0.38) | DRD2DRD3HCRTR2CYP2D6KDM4E | |
| SCHEMBL9585384 | 0.82 | DRD2 (0.38) | DRD2DRD3HCRTR2CYP2D6KDM4E | |
| SCHEMBL24075797 | 0.81 | DRD2 (0.44) | DRD2DRD3HCRTR2ABCB1CHRNA1 | |
| SCHEMBL24090487 | 0.81 | DRD2 (0.44) | DRD2DRD3HCRTR2ABCB1CHRNA1 |
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-5447943-A | Smooth muscle relaxants or bronchodilators | SYNTEX (U.S.A.) INC. (US) | 1995-09-05 | — | — | US | disclosed |
| US-5250547-A | Potassium channel activators; 5-lipoxygenase inhibitors; muscle relaxants; bronchodilators | SYNTEX (U.S.A.) INC. (US) | 1993-10-05 | — | — | US | disclosed |
| EP-0529654-A1 | Benzopyran derivatives as potassium channel activators and 5-lipoxygenase inhibitors | SYNTEX (U.S.A.) INC. (US) | 1993-03-03 | — | — | EP | disclosed |