Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | RAC1 | P63000 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7317441 | 0.87 | KDM4E (0.39) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| SCHEMBL7307941 | 0.86 | PDE3B (0.35) | KDM4EPDE3BPDE3AGAAMT-CO2 | |
| SCHEMBL7315403 | 0.83 | SLC10A2 (0.37) | KDM4EMEN1KMT2AGAAPOLB | |
| SCHEMBL7312102 | 0.82 | PDE3B (0.46) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| SCHEMBL9832514 | 0.74 | KDM4E (0.42) | KDM4EMEN1KMT2ARAC1GAA | |
| SCHEMBL7447294 | 0.74 | KDM4E (0.42) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| SCHEMBL6313239 | 0.72 | KDM4E (0.49) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| SCHEMBL12325390 | 0.72 | CYP3A4 (0.46) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL27947697 | 0.72 | KDM4E (0.46) | KDM4EPDE3BPDE3AMEN1KMT2A | |
| SCHEMBL7445322 | 0.71 | ALDH1A1 (0.47) | KDM4EMEN1KMT2ARAC1GAA |
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 |