Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL9781802 | 0.79 | CA12 (0.53) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL16141745 | 0.76 | ALDH1A1 (0.54) | SMN1; SMN2ALDH1A1LMNAGAAMAPT | |
| SCHEMBL7675476 | 0.75 | ALDH1A1 (0.43) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL3345207 | 0.75 | CA12 (0.68) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL10371413 | 0.75 | KDM4E (0.70) | ALDH1A1LMNAKMT2ALTA4HTSHR | |
| SCHEMBL11845550 | 0.74 | SMN1; SMN2 (0.73) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL18255543 | 0.74 | KDM4E (0.52) | SMN1; SMN2ALDH1A1LMNAGAAMAPT | |
| SCHEMBL9781286 | 0.73 | ALDH1A1 (0.69) | SMN1; SMN2ALDH1A1LMNAGAAKMT2A | |
| SCHEMBL11415896 | 0.73 | LTA4H (0.60) | SMN1; SMN2ALDH1A1LMNAGAAMAPT | |
| SCHEMBL31322152 | 0.73 | LTA4H (0.66) | SMN1; SMN2ALDH1A1LMNAGAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0251294-B1 | SUBSTITUTED ISOQUINOLINE DERIVATIVES AND ANTI-ULCER AGENTS | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1990-09-19 | — | — | EP | disclosed |
| US-4882338-A | Substituted isoquinoline derivatives and anti-ulcer agents | SHIONOGI & CO., LTD. (JP) | 1989-11-21 | — | — | US | disclosed |
| EP-0251294-A1 | Substituted isoquinoline derivatives and anti-ulcer agents | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1988-01-07 | — | — | EP | disclosed |