Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.51 |
| ▸ | IL4I1 | Q96RQ9 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | IDH1 | O75874 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL32681268 | 0.80 | KDM4E (0.67) | ALDH1A1NPSR1TSHRKDM4EIL4I1 | |
| SCHEMBL3717832 | 0.80 | IL4I1 (0.66) | ALDH1A1NPSR1KDM4EIL4I1IDH1 | |
| SCHEMBL30162737 | 0.72 | MAPT (0.67) | ALDH1A1NPSR1TSHRKDM4EMAPT | |
| SCHEMBL24852055 | 0.72 | CYP19A1 (0.52) | IL4I1IDH1 | |
| SCHEMBL24852632 | 0.72 | MAPT (0.67) | ALDH1A1NPSR1TSHRKDM4EMAPT | |
| SCHEMBL24851915 | 0.72 | IDH1 (0.48) | ALDH1A1NPSR1TSHRKDM4EIL4I1 | |
| SCHEMBL24852522 | 0.71 | IL4I1 (0.61) | ALDH1A1NPSR1TSHRKDM4EIL4I1 | |
| SCHEMBL31065667 | 0.69 | BRD4 (0.60) | ALDH1A1NPSR1TSHRKDM4EIL4I1 | |
| SCHEMBL24852766 | 0.69 | KDM4E (0.65) | ALDH1A1NPSR1TSHRKDM4EIL4I1 | |
| SCHEMBL24853037 | 0.69 | IL4I1 (0.61) | ALDH1A1NPSR1TSHRKDM4EIL4I1 |
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-2023278222-A1 | IL4I1 INHIBITORS AND METHODS OF USE | MERCK SHARP & DOHME LLC (US) | 2023-01-05 | — | — | WO | disclosed |