Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 5/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.66 |
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 3/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL19114989 | 0.90 | EPHX2 (0.68) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL25328235 | 0.90 | THRB (0.77) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL1388180 | 0.88 | THRB (0.70) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL9809561 | 0.86 | RAB9A (0.76) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL17822214 | 0.86 | EPHX2 (0.75) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL3514765 | 0.85 | EPHX2 (0.69) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL30664046 | 0.85 | THRB (0.75) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL5483064 | 0.85 | EPHX2 (0.73) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL62572 | 0.85 | THRB (0.75) | THRBMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL9763664 | 0.85 | EPHX2 (0.73) | THRBMEN1KMT2ARAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017120355-A1 | DIHYDROQUINOLINES AND USES THEREOF | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2017-07-13 | — | — | WO | disclosed |
| EP-2658839-B1 | PROCESS FOR THE MANUFACTURE OF NICORANDIL | PROCOS SPA (IT) | 2014-10-22 | — | — | EP | disclosed |