Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8007687 | 0.73 | MMP2 (0.47) | HRH4HRH3MMP2ALDH1A1KDM4E | |
| SCHEMBL727185 | 0.73 | CYP1A2 (0.62) | HRH4HRH3MMP2CYP1A2CYP2D6 | |
| SCHEMBL31688985 | 0.69 | TAAR1 (0.68) | HRH4HRH3MMP2CYP1A2CYP2D6 | |
| SCHEMBL6168636 | 0.69 | TAAR1 (0.68) | HRH4HRH3MMP2CYP1A2CYP2D6 | |
| SCHEMBL7370545 | 0.68 | CYP2C19 (0.56) | HRH4HRH3MMP2CYP1A2CYP2D6 | |
| SCHEMBL3335641 | 0.68 | GAA (0.71) | KDM4EGAACACNA1H | |
| SCHEMBL29995759 | 0.68 | CYP11B1 (0.65) | HRH4HRH3CYP1A2CYP2D6CHRNA7 | |
| SCHEMBL177863 | 0.68 | CYP11B1 (0.65) | HRH4HRH3CYP1A2CYP2D6CHRNA7 | |
| SCHEMBL14257669 | 0.68 | CYP1A2 (0.56) | HRH4HRH3MMP2CYP1A2CYP2D6 | |
| SCHEMBL4016895 | 0.67 | DCUN1D1 (0.63) | ALDH1A1KDM4EGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009087218-A1 | THIAZOLTRIAZOLES AND THIAZOLIMIDAZOLES AS ANTAGONISTS OF THE MGLUR5 RECEPTOR | GLAXO GROUP LIMITED (GB) | 2009-07-16 | — | — | WO | disclosed |