Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CHKA | P35790 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 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 SCHEMBL11283067 | 1.00 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Pyrrolidine SCHEMBL4076061 | 0.97 | ALDH1A1 (0.50) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL3283269 | 0.90 | ALDH1A1 (0.60) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL7344752 | 0.90 | ALDH1A1 (0.60) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL10778074 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Azepane SCHEMBL29776406 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL8761997 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Azepane SCHEMBL9998550 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL1793471 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM | |
| Piperidine SCHEMBL27445219 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4EKMT2AMAPTATM |
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-4321269-A | 1-(3-Halo-1,2-dioxopropyl)-cycloamine compositions and use | SANDOZ, INC. (US) | 1982-03-23 | — | — | US | disclosed |