Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 17/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 16/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 9/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5833062 | 0.96 | CYP1A2 (0.38) | TLR7CYP1A2CYP3A4CLK4HSD17B10 | |
| Ethylenediamine SCHEMBL5884629 | 0.95 | TLR7 (0.39) | TLR7CYP1A2CYP3A4CLK4HSD17B10 | |
| SCHEMBL5833413 | 0.79 | CYP1A2 (0.38) | CYP1A2CYP3A4CLK4HSD17B10CYP2D6 | |
| SCHEMBL24180048 | 0.79 | CYP1A2 (0.42) | CYP1A2CYP3A4CLK4HSD17B10CYP2D6 | |
| SCHEMBL25590589 | 0.78 | HRH4 (0.42) | TLR7CYP1A2CYP3A4CLK4HSD17B10 | |
| SCHEMBL20204090 | 0.76 | HRH1 (0.36) | CYP1A2CYP3A4CLK4HSD17B10CYP2D6 | |
| SCHEMBL2261177 | 0.76 | CYP1A2 (0.40) | CYP1A2CYP3A4CLK4HSD17B10CYP2D6 | |
| SCHEMBL7992424 | 0.75 | SIRT6 (0.36) | TLR7MEN1KMT2AALDH1A1TP53 | |
| SCHEMBL5884099 | 0.75 | MC4R (0.42) | CYP1A2CYP2C19KDM4E | |
| SCHEMBL11365092 | 0.74 | CYP3A4 (0.36) | CYP1A2CYP3A4CLK4HSD17B10CYP2D6 |
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-RE39129-E1 | Heterocyclic compounds | BAYER CROPSCIENCE K.K. (JP) | 2006-06-13 | — | — | US | disclosed |