Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22538519 | 0.92 | KCNH2 (0.38) | MLYCDTP53ALDH1A1LMNACES2 | |
| SCHEMBL21507868 | 0.83 | HPGD (0.40) | MLYCDALDH1A1LMNACES2CES1 | |
| SCHEMBL21078085 | 0.82 | TP53 (0.47) | TP53ALDH1A1LMNACES2CES1 | |
| SCHEMBL23280377 | 0.79 | L3MBTL1 (0.40) | ALDH1A1LMNAEGFRERBB2KCNH2 | |
| SCHEMBL20156934 | 0.77 | HPGD (0.40) | MLYCDTP53ALDH1A1LMNAEGFR | |
| SCHEMBL9357131 | 0.76 | CA12 (0.41) | MLYCDTP53ALDH1A1LMNACES2 | |
| SCHEMBL7967022 | 0.76 | MLYCD (0.64) | MLYCDTP53ALDH1A1LMNACES2 | |
| SCHEMBL19367916 | 0.74 | TXNRD1 (0.32) | NPC1RAB9AKCNH2 | |
| SCHEMBL31384410 | 0.73 | CES2 (0.54) | MLYCDTP53ALDH1A1LMNACES2 | |
| SCHEMBL23717098 | 0.73 | GSK3B (0.37) | MLYCDTP53ALDH1A1LMNACES2 |
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-3189041-B1 | TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS | CTXT PTY LTD (AU) | 2021-04-28 | — | — | EP | disclosed |
| WO-2020263186-A1 | COMPOUNDS FOR TREATMENT OF CANCER | SINOPSEE THERAPEUTICS (SG) | 2020-12-30 | — | — | WO | disclosed |
| WO-2005103055-A1 | PYRAZOLO-[4,3-e]-1,2,4-TRIAZOLO-[1,5-c]-PYRIMIDINE ADENOSINE A2A RECEPTOR ANTAGONISTS | SCHERING CORPORATION (US) | 2005-11-03 | — | — | WO | disclosed |