Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3964100 | 0.85 | ALDH1A1 (0.56) | ALDH1A1LMNAPKMGAAKMT2A | |
| SCHEMBL3620511 | 0.84 | ALDH1A1 (0.53) | ALDH1A1MAPTLMNAPKMGAA | |
| SCHEMBL3620510 | 0.84 | ALDH1A1 (0.53) | ALDH1A1MAPTLMNAPKMGAA | |
| SCHEMBL4974688 | 0.78 | ALDH1A1 (0.46) | ALDH1A1MAPTLMNAPKMGAA | |
| SCHEMBL4082779 | 0.77 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1KDM4E | |
| SCHEMBL27778356 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MAPTLMNAPKMGAA | |
| SCHEMBL4971227 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNAPKMGAA | |
| SCHEMBL4754555 | 0.75 | PROKR1 (0.48) | — | |
| SCHEMBL4982747 | 0.74 | HPGD (0.54) | ALDH1A1MAPTGAAKMT2AMEN1 | |
| SCHEMBL21926564 | 0.74 | ALDH1A1 (0.73) | ALDH1A1MAPTLMNAPKMGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101356156-B | Aspartic protease inhibitors | VITAE PHARMACEUTICALS INC | 2012-12-05 | — | — | CN | disclosed |
| EP-2074108-A1 | RENIN INHIBITORS | Vitae Pharmaceuticals, Inc. (US) | 2009-07-01 | — | — | EP | disclosed |
| CN-101356156-A | Aspartic protease inhibitors | VITAE PHARMACEUTICALS INC (US) | 2009-01-28 | — | — | CN | disclosed |
| WO-2008036247-A1 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2008-03-27 | — | — | WO | disclosed |