Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR139 | Q6DWJ6 | 6/20 | 0.40 |
| ▸ | AURKA | O14965 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 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 | |
|---|---|---|---|---|
| SCHEMBL531078 | 1.00 | GPR139 (0.40) | GPR139AURKAHTTKDM4ECYP1A2 | |
| SCHEMBL531306 | 0.85 | GPR139 (0.48) | GPR139AURKAHTTKDM4EPTGDR2 | |
| SCHEMBL531305 | 0.85 | GPR139 (0.48) | GPR139AURKAHTTKDM4EPTGDR2 | |
| SCHEMBL528378 | 0.84 | KMT2A (0.40) | HTTKDM4ESMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL528451 | 0.81 | ALDH1A1 (0.39) | GPR139HTTKDM4ESMN1; SMN2KMT2A | |
| SCHEMBL528115 | 0.81 | ALDH1A1 (0.39) | GPR139HTTKDM4ESMN1; SMN2KMT2A | |
| SCHEMBL528906 | 0.79 | ALDH1A1 (0.37) | GPR139KDM4ESMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL528905 | 0.79 | ALDH1A1 (0.37) | GPR139KDM4ESMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL528033 | 0.77 | MMP2 (0.44) | GPR139HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL528034 | 0.77 | MMP2 (0.44) | GPR139HTTCYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2598493-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-06-05 | — | — | EP | disclosed |
| WO-2012014114-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-02-02 | — | — | WO | disclosed |