Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 10/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | DRD1 | P21728 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MLNR | O43193 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7654660 | 0.88 | BCHE (0.48) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| SCHEMBL7652372 | 0.85 | BCHE (0.48) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| SCHEMBL7652346 | 0.84 | BCHE (0.52) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| SCHEMBL7652044 | 0.84 | CACNA1G (0.53) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| Hydrochloric Acid SCHEMBL7650573 | 0.83 | BCHE (0.49) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| Hydrochloric Acid SCHEMBL7650323 | 0.83 | UBE2N (0.51) | BCHEHPGDSLMNACACNA1GCACNA1H | |
| SCHEMBL7651155 | 0.83 | BCHE (0.54) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| SCHEMBL7654668 | 0.83 | BCHE (0.44) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| Hydrochloric Acid SCHEMBL7652912 | 0.82 | BCHE (0.49) | BCHEHPGDSCHRM2HTR1AADRA2A | |
| SCHEMBL7650486 | 0.82 | BCHE (0.53) | BCHEHPGDSCHRM2HTR1AADRA2A |
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 |