Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.51 |
| ▸ | MMP3 | P08254 | 2/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.48 |
| ▸ | CLK1 | P49759 | 1/20 | 0.48 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.48 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.48 |
| ▸ | MYC | P01106 | 1/20 | 0.48 |
| ▸ | MAX | P61244 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.48 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SI | P14410 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4050471 | 1.00 | PTGS2 (0.51) | PTGS2HRH3MMP3MMP13HPGD | |
| SCHEMBL4049602 | 0.83 | MMP13 (0.69) | PTGS2HRH3MMP3MMP13HPGD | |
| SCHEMBL4049607 | 0.83 | MMP13 (0.69) | PTGS2HRH3MMP3MMP13HPGD | |
| SCHEMBL4050826 | 0.82 | MMP13 (0.71) | PTGS2MMP3MMP13HPGDPOLB | |
| SCHEMBL4050829 | 0.82 | MMP13 (0.71) | PTGS2MMP3MMP13HPGDPOLB | |
| SCHEMBL4057273 | 0.82 | MYC (0.57) | PTGS2HRH3MMP3MMP13HPGD | |
| SCHEMBL4057275 | 0.82 | HRH3 (0.58) | PTGS2HRH3MMP3MMP13HPGD | |
| SCHEMBL4052863 | 0.80 | MYC (0.46) | PTGS2HPGDMYCMAXMEN1 | |
| SCHEMBL4052867 | 0.80 | MYC (0.46) | PTGS2HPGDMYCMAXMEN1 | |
| SCHEMBL4053874 | 0.78 | ALDH1A1 (0.46) | HRH3MEN1POLBKMT2AGPR35 |
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-2009109999-A1 | NOVEL PROTEIN TYROSINE PHOSPHATASE - IB INHIBITORS | LUPIN LIMITED (IN) | 2009-09-11 | — | — | WO | disclosed |