Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 1/20 | 0.39 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 2/20 | 0.38 |
| ▸ | TNF | P01375 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7446369 | 0.90 | MEN1 (0.40) | NTSR1DPP4TNFALDH1A1KDM4E | |
| SCHEMBL7440312 | 0.87 | NCEH1 (0.40) | NTSR1DPP4TNFALDH1A1KDM4E | |
| SCHEMBL7437559 | 0.86 | KMT2A (0.41) | VCPTNFALDH1A1KDM4ELMNA | |
| SCHEMBL7444368 | 0.85 | NTSR1 (0.45) | VCPNTSR1LMNACASP3SENP6 | |
| SCHEMBL7443770 | 0.84 | KMT2A (0.47) | NTSR1ALDH1A1KDM4EGAAMEN1 | |
| SCHEMBL9830708 | 0.82 | MEN1 (0.44) | NTSR1DPP4ALDH1A1KDM4EGAA | |
| SCHEMBL7439631 | 0.81 | MAPT (0.40) | VCPALDH1A1KDM4EGAALMNA | |
| SCHEMBL7444737 | 0.81 | PDE3B (0.44) | DPP4TNFALDH1A1GAALMNA | |
| SCHEMBL7441183 | 0.80 | LMNA (0.39) | ALDH1A1KDM4ELMNACASP3SENP8 | |
| SCHEMBL7443752 | 0.72 | KDM4E (0.36) | ALDH1A1KDM4EMAPTBLMTDP1 |
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-4880817-A | O-functionalized derivatives of substituted isoquinolin-3-ols having cardiotonic and/or phosphodiesterase fraction III inhibiting properties and/or renal vasodilating properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-11-14 | — | — | US | claimed |