Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.44 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.44 |
| ▸ | OXTR | P30559 | 1/20 | 0.44 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 3/20 | 0.41 |
| ▸ | BCR | P11274 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5744595 | 1.00 | ALDH1A1 (0.53) | ALDH1A1LMNAMKNK1MKNK2AVPR2 | |
| SCHEMBL5741756 | 0.92 | CA12 (0.47) | ALDH1A1LMNAMEN1KMT2ACA12 | |
| SCHEMBL5741758 | 0.92 | CA12 (0.47) | ALDH1A1LMNAMEN1KMT2ACA12 | |
| SCHEMBL5745769 | 0.92 | ALDH1A1 (0.48) | ALDH1A1LMNAMEN1KMT2APKM | |
| SCHEMBL5745771 | 0.92 | ALDH1A1 (0.48) | ALDH1A1LMNAMEN1KMT2APKM | |
| SCHEMBL4936043 | 0.86 | OXTR (0.49) | ALDH1A1LMNAMKNK1MKNK2AVPR2 | |
| SCHEMBL4936051 | 0.86 | OXTR (0.49) | ALDH1A1LMNAMKNK1MKNK2AVPR2 | |
| SCHEMBL5742550 | 0.78 | MKNK1 (0.46) | ALDH1A1MKNK1MKNK2AVPR2OXTR | |
| SCHEMBL5742548 | 0.78 | MKNK1 (0.46) | ALDH1A1MKNK1MKNK2AVPR2OXTR | |
| SCHEMBL4943212 | 0.77 | OXTR (0.49) | ALDH1A1LMNAOXTRAVPR1AMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268419-B1 | PYRROLIDINE DERIVATIVES USEFUL AS BAX INHIBITORS | APPLIED RESEARCH SYSTEMS (AN) | 2006-06-21 | — | — | EP | claimed |