Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 6/20 | 0.35 |
| ▸ | HTR1D | P28221 | 6/20 | 0.35 |
| ▸ | HTR1B | P28222 | 6/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 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 | |
|---|---|---|---|---|
| SCHEMBL12235341 | 0.86 | HTT (0.35) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL17076828 | 0.85 | TSHR (0.33) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL12212770 | 0.85 | ALDH1A1 (0.38) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL17813516 | 0.74 | HTR1D (0.41) | HTTTSHRHTR1AHTR1DHTR1B | |
| SCHEMBL12212788 | 0.73 | SYK (0.55) | PLK1MAPK1 | |
| SCHEMBL12236664 | 0.72 | HTT (0.45) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL12212778 | 0.71 | ALDH1A1 (0.64) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL23856735 | 0.68 | DGAT1 (0.37) | HTTTSHRUSP2PLK1KDM4E | |
| SCHEMBL21671699 | 0.67 | HTT (0.44) | HTTTSHRUSP2PLK1HTR1A | |
| SCHEMBL23857189 | 0.65 | TSHR (0.38) | HTTTSHRUSP2PLK1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2558474-B1 | 2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND PRODRUGS THEREOF AND THEIR USES | RIGEL PHARMACEUTICALS INC (US) | 2015-11-25 | — | — | EP | disclosed |