Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.34 |
| ▸ | ITGAL | P20701 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11464659 | 0.85 | PDE7A (0.47) | PDE7ACYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL6068604 | 0.84 | PDE7A (0.50) | PDE7ACYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL15903377 | 0.80 | TDP1 (0.45) | PDE7ACYP3A4ALDH1A1MAPK1MAPT | |
| SCHEMBL15902849 | 0.80 | PDE7A (0.46) | PDE7ACYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL2033033 | 0.78 | CYP3A4 (0.47) | PDE7ACYP3A4TSHRALDH1A1MAPT | |
| SCHEMBL24759166 | 0.77 | GABRP (0.43) | PDE7ACYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL13115676 | 0.77 | DDAH1 (0.48) | PDE7ACYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL11472720 | 0.77 | CYP3A4 (0.50) | PDE7ACYP3A4TSHRALDH1A1MAPT | |
| SCHEMBL11472785 | 0.77 | CYP1A1 (0.33) | TSHRCYP1A2CYP1A1CYP1B1MEN1 | |
| SCHEMBL15902842 | 0.77 | PDE7A (0.43) | PDE7ACYP3A4TSHRALDH1A1MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4198407-A | Substituted 2-phenyl-1,2,4-triazine-3,5(2H,4H)-diones, and coccidiostatic agents containing same | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-04-15 | — | — | US | disclosed |