Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | OTC | P00480 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 3/20 | 0.36 |
| ▸ | ERAP2 | Q6P179 | 3/20 | 0.36 |
| ▸ | FDPS | P14324 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.32 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Piperidine SCHEMBL11663522 | 0.97 | ALDH1A1 (0.45) | ALDH1A1OTCANPEPERAP2FDPS | |
| Pyrrolidine SCHEMBL27735935 | 0.80 | ALDH1A1 (0.47) | ALDH1A1ANPEPERAP2FDPSCXCR4 | |
| Pyrrolidine SCHEMBL23354581 | 0.80 | ALDH1A1 (0.53) | ALDH1A1FDPSCYP3A4BLMPMP22 | |
| Pyrrolidine SCHEMBL28575035 | 0.80 | ALDH1A1 (0.53) | ALDH1A1FDPSCYP3A4BLMPMP22 | |
| Pyrrolidine SCHEMBL29601650 | 0.80 | ALDH1A1 (0.53) | ALDH1A1FDPSCYP3A4BLMPMP22 | |
| Morpholine SCHEMBL11664356 | 0.78 | MEN1 (0.48) | ALDH1A1OTCANPEPERAP2LMNA | |
| Piperidine SCHEMBL5874248 | 0.77 | ALDH1A1 (0.60) | ALDH1A1FDPSCXCR4SMN1; SMN2MMP2 | |
| Piperidine SCHEMBL5874242 | 0.77 | ALDH1A1 (0.60) | ALDH1A1FDPSCXCR4SMN1; SMN2MMP2 | |
| Piperidine SCHEMBL9857707 | 0.77 | ALDH1A1 (0.60) | ALDH1A1FDPSCXCR4SMN1; SMN2MMP2 | |
| Pyrrolidine SCHEMBL28409763 | 0.77 | ALDH1A1 (0.50) | ALDH1A1FDPSCXCR4SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4127401-A | Aminomethanephosphonic acid compounds containing plant-growth regulant compositions | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-28 | — | — | US | disclosed |