Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CRHBP | P24387 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL464374 | 0.98 | CA12 (0.54) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL8408142 | 0.84 | GABRA1 (0.50) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL7559310 | 0.84 | KMT2A (0.53) | SMN1; SMN2ABCB1KDM4EALDH1A1ABCG2 | |
| SCHEMBL27981326 | 0.84 | L3MBTL1 (0.55) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL95872 | 0.83 | CA12 (0.53) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL3306584 | 0.83 | SMN1; SMN2 (0.54) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL7281853 | 0.82 | CA12 (0.55) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL9287986 | 0.81 | P2RX7 (0.45) | CA12CA1CA2CA14SMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL265951 | 0.80 | IDO1 (0.57) | CA12CA1CA2CA14KDM4E | |
| Propane SCHEMBL27582651 | 0.80 | SMN1; SMN2 (0.60) | CA12CA1CA2CA14SMN1; 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-4822800-A | Isoquinolinol compounds having cardiotonic and phosphodiesterase fraction III inhibiting properties and/or renal vasodilating properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-04-18 | — | — | US | disclosed |