Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4076810 | 0.92 | — | — | |
| SCHEMBL23253117 | 0.80 | CYP46A1 (0.33) | AVPR1AALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL1972942 | 0.78 | SLC6A2 (0.33) | AVPR1AALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL21840110 | 0.78 | CYP46A1 (0.40) | AVPR1AALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL20702372 | 0.78 | AVPR1A (0.32) | AVPR1AALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL238639 | 0.77 | PKLR (0.34) | AVPR1AALDH1A1LMNA | |
| SCHEMBL28219846 | 0.75 | CYP2D6 (0.32) | AVPR1AALDH1A1LMNA | |
| SCHEMBL2141413 | 0.75 | AVPR1A (0.31) | AVPR1AALDH1A1LMNA | |
| SCHEMBL10694845 | 0.75 | L3MBTL1 (0.51) | ALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL4765795 | 0.74 | — | — |
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-2035435-A1 | NOVEL LAPACHONE COMPOUNDS AND METHODS OF USE THEREOF | ARQULE, INC. (US) | 2009-03-18 | — | — | EP | disclosed |
| WO-2007139569-A1 | NOVEL LAPACHONE COMPOUNDS AND METHODS OF USE THEREOF | ARQULE, INC. (US) | 2007-12-06 | — | — | WO | disclosed |