Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CKS1B | P61024 | 1/20 | 0.35 |
| ▸ | SKP1 | P63208 | 1/20 | 0.35 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5777696 | 0.82 | KDM4E (0.49) | KDM4ELMNAGRM5ALDH1A1RXFP1 | |
| SCHEMBL1857045 | 0.82 | ALDH1A1 (0.48) | KDM4ELMNAGRM5ALDH1A1LCK | |
| SCHEMBL29988307 | 0.81 | KDM4E (0.62) | KDM4ELMNAGRM5ALDH1A1LCK | |
| SCHEMBL5777729 | 0.81 | KDM4E (0.62) | KDM4ELMNAGRM5ALDH1A1LCK | |
| SCHEMBL29394473 | 0.80 | LCK (0.47) | LCKRXFP1MEN1KMT2APOLB | |
| SCHEMBL6238614 | 0.80 | KDM4E (0.43) | KDM4ELMNAGRM5ALDH1A1LCK | |
| SCHEMBL29510654 | 0.78 | ALDH1A1 (0.51) | LMNAGRM5ALDH1A1LCKRXFP1 | |
| SCHEMBL22523913 | 0.78 | LCK (0.43) | LCKMEN1KMT2AATRNPC1 | |
| SCHEMBL1712579 | 0.78 | ALDH1A1 (0.51) | LMNAGRM5ALDH1A1LCKRXFP1 | |
| SCHEMBL23232473 | 0.78 | TRPM8 (0.36) | LCKATRRAB9AGSK3BDYRK1A |
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-1652839-A2 | Drug efflux pump inhibitor | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-05-03 | — | — | EP | disclosed |
| EP-1227084-B1 | DRUG DISCHARGE PUMP INHIBITORS | TRINE PHARMACEUTICALS INC (US) | 2005-12-14 | — | — | EP | disclosed |
| EP-1227084-A1 | DRUG DISCHARGE PUMP INHIBITORS | Microcide Pharmaceuticals, Inc. (US) | 2002-07-31 | — | — | EP | disclosed |