Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 1.00 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CHKA | P35790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12068406 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| Azepane SCHEMBL11361504 | 1.00 | — | — | |
| SCHEMBL3498160 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| Piperidine SCHEMBL8435190 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| SCHEMBL8253733 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| SCHEMBL11508384 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| SCHEMBL3069642 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| Piperidine SCHEMBL11283826 | 1.00 | — | — | |
| SCHEMBL21753221 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT | |
| SCHEMBL6890150 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CXCR4SMN1; SMN2HIF1AMAPT |
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-3507330-B1 | THERMOPLASTIC MOULDING MATERIALS | LANXESS DEUTSCHLAND GMBH (DE) | 2020-04-01 | — | — | EP | disclosed |