Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ERN1 | O75460 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12675810 | 0.82 | ERN1 (0.65) | HPGDTSHRERN1NPC1SCN9A | |
| SCHEMBL21763595 | 0.76 | ERN1 (0.60) | HPGDTSHRERN1KCNH2MAPT | |
| SCHEMBL13551886 | 0.75 | HPGD (0.47) | HPGDTSHRERN1NPC1SCN9A | |
| SCHEMBL21763695 | 0.73 | ERN1 (0.54) | ERN1NPC1KCNH2KDM4ESMN1; SMN2 | |
| SCHEMBL21763560 | 0.72 | ERN1 (0.70) | ERN1NPC1MAPT | |
| SCHEMBL24368722 | 0.72 | HPGD (0.54) | HPGDTSHRSCN9AMEN1KMT2A | |
| SCHEMBL21763684 | 0.71 | KDM4E (0.41) | HPGDTSHRERN1NPC1MAPT | |
| SCHEMBL21763657 | 0.70 | ERN1 (0.49) | ERN1NPC1KMT2AKCNH2KDM4E | |
| SCHEMBL21763659 | 0.70 | HTR3A (0.56) | ERN1NPC1MEN1CYP1A2KMT2A | |
| SCHEMBL10724841 | 0.69 | POLB (0.81) | HPGDTSHRNPC1POLBMEN1 |
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-2496230-B1 | IRE-1 ALPHA INHIBITORS | FOSUN ORINOVE PHARMATECH INC (CN) | 2020-02-26 | — | — | EP | disclosed |