Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ERN1 | O75460 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KIT | P10721 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | WNT1 | P04628 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12675652 | 0.82 | ERN1 (0.62) | TDP1ERN1 | |
| SCHEMBL21763575 | 0.80 | SMN1; SMN2 (0.49) | ERN1ALDH1A1MAPTTP53POLB | |
| SCHEMBL27891120 | 0.75 | TDP1 (0.53) | TDP1ALDH1A1MAPTMETHDAC2 | |
| SCHEMBL21763659 | 0.74 | HTR3A (0.56) | ERN1ALDH1A1 | |
| SCHEMBL21763657 | 0.73 | ERN1 (0.49) | ERN1KCNH2KDRWNT1GSK3B | |
| SCHEMBL8249743 | 0.71 | CHEK1 (0.53) | TDP1KCNH2HDAC2TP53NPSR1 | |
| SCHEMBL21763595 | 0.71 | ERN1 (0.60) | ERN1KCNH2ALDH1A1MAPT | |
| SCHEMBL21763695 | 0.70 | ERN1 (0.54) | ERN1KCNH2TNKS | |
| SCHEMBL444649 | 0.70 | TDP1 (0.50) | TDP1KCNH2ALDH1A1HDAC2TP53 | |
| SCHEMBL1554083 | 0.68 | TDP1 (1.00) | TDP1ALDH1A1MAPTHDAC2TP53 |
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 |