Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13853577 | 0.86 | CA12 (0.69) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL11415896 | 0.80 | LTA4H (0.60) | SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL31322152 | 0.80 | LTA4H (0.66) | SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL10374685 | 0.79 | CA12 (0.51) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL3691758 | 0.79 | PPARA (0.62) | SMN1; SMN2ALDH1A1KDM4EKMT2ACYP2D6 | |
| SCHEMBL11426661 | 0.78 | LTA4H (0.58) | ALDH1A1KDM4EKMT2AMEN1CYP2D6 | |
| SCHEMBL11618535 | 0.76 | KDM4E (0.70) | SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL18255545 | 0.76 | KDM4E (0.59) | SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1 | |
| Acetone SCHEMBL4796453 | 0.76 | KDM4E (0.59) | SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL11845550 | 0.76 | SMN1; SMN2 (0.73) | CA12CA1CA2CA9SMN1; SMN2 |
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-5066658-A | Enzyme Inhibitors; Bronchodilators; Antiinflammatory Agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1991-11-19 | — | — | US | disclosed |