Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4438837 | 0.93 | ALDH1A1 (0.49) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4426834 | 0.92 | ALDH1A1 (0.54) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4426842 | 0.92 | KDM4E (0.49) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4438532 | 0.88 | ALDH1A1 (0.47) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4429436 | 0.87 | KDM4E (0.53) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL3913842 | 0.86 | KDM4E (0.51) | KDM4EGAAGLAALDH1A1TSHR | |
| SCHEMBL4433934 | 0.86 | KDM4E (0.51) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4428291 | 0.85 | KDM4E (0.48) | KDM4EGAAGLAALDH1A1RNASEH1 | |
| SCHEMBL4428809 | 0.84 | DAO (0.48) | KDM4EGAAGLAALDH1A1MAPT | |
| SCHEMBL4430805 | 0.84 | KDM4E (0.47) | KDM4EGAAGLAALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3814330-A1 | IMMUNOMODULATORY COMPOUNDS | Dana-Farber Cancer Institute, Inc. (US) | 2021-05-05 | — | — | EP | disclosed |
| EP-1737451-A2 | MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS | Bristol-Myers Squibb Company (US) | 2007-01-03 | — | — | EP | disclosed |
| WO-2005117867-A2 | MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-12-15 | — | — | WO | disclosed |