Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.59 |
| ▸ | LCK | P06239 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | APEX1 | P27695 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8743681 | 1.00 | EGFR (0.59) | EGFRLCKKDM4EMEN1KMT2A | |
| SCHEMBL21457670 | 0.85 | EGFR (0.58) | EGFRKDM4EKMT2AALDH1A1HPGD | |
| SCHEMBL21457666 | 0.85 | EGFR (0.58) | EGFRKDM4EKMT2AALDH1A1HPGD | |
| SCHEMBL8743687 | 0.84 | MAPT (0.53) | EGFRKDM4EMEN1KMT2AMAPT | |
| SCHEMBL21457354 | 0.80 | ADORA2A (0.75) | KDM4EMEN1KMT2AMAPTPOLB | |
| SCHEMBL21457357 | 0.80 | ADORA2A (0.75) | KDM4EMEN1KMT2AMAPTPOLB | |
| SCHEMBL21457337 | 0.78 | ALDH1A1 (0.57) | KDM4EMEN1KMT2AMAPTPOLB | |
| SCHEMBL21457333 | 0.78 | ALDH1A1 (0.57) | KDM4EMEN1KMT2AMAPTPOLB | |
| SCHEMBL1388529 | 0.78 | EGFR (0.59) | EGFRLCKKDM4EMEN1KMT2A | |
| SCHEMBL1388528 | 0.78 | EGFR (0.59) | EGFRLCKKDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021231762-A2 | COMBINATION THERAPY FOR THE TREATMENT OF TNBC WITH A PI3K PATHWAY INHIBITOR THAT TARGETS PI3KDELTA AND PI3KGAMMA TNBC | THE TRUSTEES OF INDIANA UNIVERSITY (US) | 2021-11-18 | — | — | WO | disclosed |
| US-9945845-B2 | Methods of screening using amphibians | BRAENDLI ANDRE W (CH) | 2018-04-17 | — | — | US | disclosed |
| US-20180059097-A1 | METHODS OF SCREENING USING AMPHIBIANS | BRAENDLI ANDRE W (CH) | 2018-03-01 | — | — | US | disclosed |