Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | RECQL | P46063 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ERN1 | O75460 | 1/20 | 0.49 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL21865015 | 0.84 | EGFR (0.60) | EGFRMAPTALDH1A1KDM4EHPGD | |
| SCHEMBL6686433 | 0.83 | MAPT (0.56) | EGFRMAPTALDH1A1KDM4EHPGD | |
| SCHEMBL9876993 | 0.81 | MAPT (0.68) | EGFRMAPTALDH1A1KDM4EHPGD | |
| SCHEMBL23413367 | 0.78 | ERN1 (0.49) | EGFRMAPTALDH1A1HPGDPOLB | |
| SCHEMBL29853796 | 0.78 | ERN1 (0.49) | EGFRMAPTALDH1A1HPGDPOLB | |
| SCHEMBL29780565 | 0.78 | ERN1 (0.49) | EGFRMAPTALDH1A1HPGDPOLB | |
| SCHEMBL918368 | 0.76 | ERN1 (0.73) | MAPTALDH1A1HPGDPOLBERN1 | |
| SCHEMBL1353698 | 0.75 | MAPT (0.64) | EGFRMAPTALDH1A1KDM4EHPGD | |
| SCHEMBL20302595 | 0.75 | GPR35 (0.56) | MAPTALDH1A1KDM4EHPGDPOLB | |
| SCHEMBL3246996 | 0.75 | APP (0.56) | EGFRMAPTALDH1A1POLBMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1487841-A1 | THIOPYRIMIDINE AND ISOTHIAZOLOPYRIMIDINE KINASE INHIBITORS | Abbott Laboratories (US) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003080625-A1 | THIOPYRIMIDINE AND ISOTHIAZOLOPYRIMIDINE KINASE INHIBITORS | ABBOTT LABORATORIES (US) | 2003-10-02 | — | — | WO | disclosed |