Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 6/20 | 0.36 |
| ▸ | HTR2A | P28223 | 6/20 | 0.36 |
| ▸ | DRD3 | P35462 | 6/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 4/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ASGR1 | P07306 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14840942 | 0.89 | PKM (0.48) | PKMDRD2HTR2ADRD3CA2 | |
| SCHEMBL14840943 | 0.89 | PKM (0.48) | PKMDRD2HTR2ADRD3CA2 | |
| SCHEMBL993860 | 0.78 | PKM (0.61) | PKMDRD2HTR2ADRD3CA2 | |
| SCHEMBL15663103 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL31662032 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL3644237 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL26906160 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL14828555 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL21069559 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB | |
| SCHEMBL3646438 | 0.77 | PDE7A (0.38) | PKMPTGESPDE7AKMT2APOLB |
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-2015002994-A2 | HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2015-01-08 | — | — | WO | disclosed |