Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | MPO | P05164 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11985495 | 0.78 | CYP1A2 (0.67) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL13332558 | 0.75 | CYP1A2 (0.62) | CYP1A2ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL3311524 | 0.74 | ALDH1A1 (0.73) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL3312291 | 0.72 | CYP1A2 (0.61) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL32680072 | 0.72 | CYP1A2 (0.61) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL9523849 | 0.72 | CYP1A2 (1.00) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL10085092 | 0.72 | POLB (0.43) | CYP1A2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL7654823 | 0.71 | MAPT (0.52) | ALDH1A1KDM4EMAPTLMNAMAPK1 | |
| SCHEMBL8692730 | 0.70 | CYP1A2 (0.76) | CYP1A2MPOALDH1A1KDM4EHPGD | |
| SCHEMBL3311829 | 0.69 | CYP1A2 (0.57) | CYP1A2MPOALDH1A1KDM4EHPGD |
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-6407116-B1 | 2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLINE DERIVATIVES; ANTIALLERGENS, ANTIASTHMATICS, ANTIHISTAMINES, AND ANTIINFLAMMATORY AGENTS | TAKEDA CHEMICAL INDUSTRIES, INC. (JP) | 2002-06-18 | — | — | US | disclosed |
| EP-1026160-A1 | NITROGENOUS FUSED-RING COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME, AND DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2000-08-09 | — | — | EP | disclosed |