Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL692107 | 0.71 | CYP1A2 (0.45) | ALDH1A1ACHECYP1A2KDM4ELMNA | |
| SCHEMBL8154900 | 0.68 | ABCG2 (0.47) | LMNAKMT2ANPC1 | |
| SCHEMBL23143295 | 0.67 | PDGFRB (0.43) | ALDH1A1KDM4ENPC1MAPK14 | |
| SCHEMBL7095463 | 0.67 | NUDT1 (0.33) | ALDH1A1KDM4EMEN1LMNAKMT2A | |
| SCHEMBL4910311 | 0.67 | ALDH1A1 (0.41) | ALDH1A1BCHEACHECYP1A2KDM4E | |
| SCHEMBL9843907 | 0.66 | ALDH1A1 (0.40) | ALDH1A1KDM4ELMNAKMT2A | |
| SCHEMBL13911042 | 0.64 | ALDH1A1 (0.41) | ALDH1A1KDM4EMEN1LMNAKMT2A | |
| SCHEMBL8168648 | 0.64 | CYP19A1 (0.44) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL28486850 | 0.62 | ALDH1A1 (0.48) | ALDH1A1BCHEACHECYP1A2KDM4E | |
| SCHEMBL4143004 | 0.62 | ALDH1A1 (0.41) | ALDH1A1CYP1A2KDM4EMEN1LMNA |
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-2877457-A1 | CYSTATHIONINE- -LYASE (CSE) INHIBITORS | Sova Pharmaceuticals, Inc. (US) | 2015-06-03 | — | — | EP | disclosed |
| WO-2014018570-A1 | CYSTATHIONINE-Υ-LYASE (CSE) INHIBITORS | SOVA PHARMACEUTICALS, INC. (US) | 2014-01-30 | — | — | WO | disclosed |