Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.74 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.74 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11576174 | 0.85 | GAA (1.00) | GAANPSR1LMNASMN1; SMN2HTT | |
| SCHEMBL21156696 | 0.84 | EPHX2 (0.64) | GAALMNASMN1; SMN2HTTMAPK1 | |
| SCHEMBL8723749 | 0.79 | GAA (0.65) | GAANPSR1LMNASMN1; SMN2HTT | |
| SCHEMBL11812190 | 0.77 | LMNA (0.68) | GAANPSR1LMNASMN1; SMN2HTT | |
| SCHEMBL15522738 | 0.74 | KMT2A (0.55) | KMT2AMAPTMEN1HDAC3HDAC1 | |
| SCHEMBL14628590 | 0.73 | LMNA (0.76) | GAANPSR1LMNASMN1; SMN2HTT | |
| SCHEMBL11761322 | 0.73 | LMNA (0.79) | GAANPSR1LMNASMN1; SMN2HTT | |
| SCHEMBL22554388 | 0.73 | EPHX2 (0.57) | GAALMNASMN1; SMN2HTTPOLB | |
| SCHEMBL11414289 | 0.73 | HDAC1 (0.65) | KMT2AMEN1HDAC3HDAC1HDAC2 | |
| SCHEMBL7825089 | 0.73 | GAA (0.76) | GAANPSR1LMNASMN1; SMN2HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4075344-A | 3-ALKOXYISOQUINOLINES FOR HYPOTENSIVE AND VASODILATING EFFECTS | MEAD JOHNSON & COMPANY (US) | 1978-02-21 | — | — | US | disclosed |
| US-4015006-A | 3(2H)-Isoquinolones therapeutic process | MEAD JOHNSON & COMPANY (US) | 1977-03-29 | — | — | US | disclosed |