Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.51 |
| ▸ | HPGDS | O60760 | 2/20 | 0.50 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12675177 | 0.86 | ERN1 (0.65) | ERN1HPGDSCD274TSHRLMNA | |
| SCHEMBL23956927 | 0.79 | CD274 (0.52) | CD274TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL288460 | 0.79 | CYP1A2 (0.55) | HPGDSCD274TSHRLMNAALDH1A1 | |
| SCHEMBL23956924 | 0.77 | TSHR (0.49) | HPGDSCD274TSHRLMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL29217421 | 0.76 | TSHR (0.48) | HPGDSCD274TSHRLMNAALDH1A1 | |
| SCHEMBL3396816 | 0.75 | HPGD (0.57) | CD274TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL290307 | 0.73 | CD274 (0.61) | HPGDSCD274TSHRLMNAALDH1A1 | |
| SCHEMBL3404510 | 0.73 | HPGD (0.49) | CD274LMNAALDH1A1MAPTHPGD | |
| SCHEMBL298546 | 0.73 | MAPK1 (0.56) | TSHRLMNAALDH1A1HSD17B10CYP2C9 | |
| SCHEMBL3398394 | 0.72 | KDM4E (0.54) | LMNAALDH1A1HSD17B10CYP2C9CYP1A2 |
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 |