Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24391770 | 0.83 | RET (0.31) | ALDH1A1RET | |
| SCHEMBL24393212 | 0.79 | ALDH1A1 (0.35) | ALDH1A1KDM4E | |
| SCHEMBL24391697 | 0.73 | ALDH1A1 (0.33) | ALDH1A1KDM4ERET | |
| SCHEMBL24393365 | 0.72 | MBOAT4 (0.35) | ALDH1A1KDM4E | |
| SCHEMBL24392052 | 0.68 | ALDH1A1 (0.35) | ALDH1A1KDM4E | |
| SCHEMBL24392134 | 0.67 | EGLN2 (0.36) | — | |
| SCHEMBL24393160 | 0.66 | ALDH1A1 (0.32) | ALDH1A1KDM4E | |
| SCHEMBL24392666 | 0.66 | ALDH1A1 (0.33) | ALDH1A1KDM4E | |
| SCHEMBL20272430 | 0.66 | IRAK4 (0.48) | — | |
| SCHEMBL25641387 | 0.66 | KDR (0.36) | — |
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-2022091048-A1 | ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF | INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) | 2022-05-05 | — | — | WO | disclosed |