Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 7/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7794112 | 0.81 | MAPT (0.52) | KCNH3TDP1ALDH1A1SMN1; SMN2THRB | |
| SCHEMBL9335465 | 0.78 | ALDH1A1 (0.47) | TDP1ALDH1A1SMN1; SMN2CYP3A4TP53 | |
| SCHEMBL22000398 | 0.77 | SMN1; SMN2 (0.47) | TDP1ALDH1A1SMN1; SMN2CYP3A4TP53 | |
| SCHEMBL9601332 | 0.74 | ALDH1A1 (0.47) | KCNH3TDP1ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL1167951 | 0.73 | ALDH1A1 (0.50) | KCNH3TDP1ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL17604274 | 0.73 | ALDH1A1 (0.50) | KCNH3TDP1ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL38657471 | 0.73 | ALDH1A1 (0.43) | KCNH3TDP1ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL28030859 | 0.72 | ALDH1A1 (0.49) | TDP1ALDH1A1SMN1; SMN2CYP3A4TP53 | |
| SCHEMBL12744307 | 0.71 | ALDH1A1 (0.78) | KCNH3TDP1ALDH1A1SMN1; SMN2CYP3A4 | |
| SCHEMBL7784548 | 0.71 | MEN1 (0.36) | KCNH3TDP1ALDH1A1CYP3A4MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1150963-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Aventis Pharma Deutschland GmbH (DE) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000046214-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-08-10 | — | — | WO | disclosed |