Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | PAOX | Q6QHF9 | 3/20 | 0.39 |
| ▸ | F13A1 | P00488 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | LOX | P28300 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 7/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | GLP1R | P43220 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20482985 | 0.82 | PMP22 (0.45) | PMP22 | |
| SCHEMBL8515872 | 0.81 | KDM4E (0.50) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL24931516 | 0.80 | KDM4E (0.44) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL4620051 | 0.79 | KDM4E (0.48) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL30777459 | 0.79 | KDM4E (0.48) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL468761 | 0.76 | KDM4E (0.56) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL12267542 | 0.74 | KDM4E (0.48) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL3993954 | 0.74 | KDM4E (0.48) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| SCHEMBL2780184 | 0.74 | KDM4E (0.54) | KDM4EMAPK1HIF1ATSHRALDH1A1 | |
| Calcium SCHEMBL2590651 | 0.74 | KDM4E (0.54) | KDM4EMAPK1HIF1ATSHRALDH1A1 |
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-2021257614-A1 | HETEROCYCLIC INHIBITORS OF ENPP1 | VOLASTRA THERAPEUTICS, INC. (US) | 2021-12-23 | — | — | WO | disclosed |