Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30254396 | 0.74 | KDM4E (0.45) | ALDH1A1KDM4EMAPTABCG2POLB | |
| SCHEMBL23885269 | 0.74 | KDM4E (0.45) | ALDH1A1KDM4EMAPTABCG2POLB | |
| SCHEMBL5766861 | 0.72 | KDM4E (0.46) | ALDH1A1KDM4EMAPTHSD17B10RXFP1 | |
| SCHEMBL5770027 | 0.72 | ALDH1A1 (0.38) | ALDH1A1KDM4EMAPTHSD17B10CYP1A2 | |
| SCHEMBL5768460 | 0.70 | PFKFB1 (0.41) | ALDH1A1KDM4EMAPTHSD17B10POLB | |
| SCHEMBL5769418 | 0.70 | NR4A2 (0.41) | ALDH1A1KDM4EMAPTRXFP1 | |
| SCHEMBL9573789 | 0.69 | TUBB4A (0.46) | ALDH1A1KDM4EMAPTHSD17B10HPGD | |
| SCHEMBL12668265 | 0.68 | SLC2A1 (0.45) | ALDH1A1KDM4EMAPTABCG2HSD17B10 | |
| SCHEMBL4707979 | 0.67 | MTNR1A (0.59) | KDM4EMAPTPOLBMTNR1AMTNR1B | |
| SCHEMBL9573872 | 0.67 | CTSS (0.40) | ALDH1A1KDM4EMAPTCYP1A2CYP3A4 |
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-1625129-A1 | HETEROCYCLYL-SUBSTITUTED DIHYDROQUINAZOLINES AND USE THEREOF AS AN ANTIVIRAL AGENT | Bayer HealthCare AG (DE) | 2006-02-15 | — | — | EP | disclosed |
| WO-2004099212-A1 | HETEROCYCLYL-SUBSTITUTED DIHYDROQUINAZOLINES AND USE THEREOF AS AN ANTIVIRAL AGENT | BAYER HEALTHCARE AG (DE) | 2004-11-18 | — | — | WO | disclosed |