Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL11870158 | 0.90 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1L3MBTL1CYP3A4 | |
| Ethane SCHEMBL11873808 | 0.87 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| Ethane SCHEMBL11873830 | 0.86 | MAPT (0.43) | ALDH1A1KDM4ETDP1L3MBTL1CYP1A2 | |
| Ethane SCHEMBL11868355 | 0.85 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| Ethane SCHEMBL11876824 | 0.84 | MAPT (0.42) | ALDH1A1KDM4ETDP1L3MBTL1CYP3A4 | |
| Ethane SCHEMBL11872785 | 0.82 | KMT2A (0.46) | ALDH1A1KDM4ETDP1L3MBTL1CYP1A2 | |
| Ethane SCHEMBL11872678 | 0.78 | ABCB1 (0.36) | ALDH1A1TDP1CYP3A4MAPTSMN1; SMN2 | |
| Ethane SCHEMBL11875478 | 0.77 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1MAPTSMN1; SMN2 | |
| Ethane SCHEMBL11877237 | 0.76 | ALDH1A1 (0.41) | ALDH1A1KDM4ETDP1L3MBTL1MAPT | |
| SCHEMBL8567480 | 0.74 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1L3MBTL1CYP1A2 |
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-3972705-A | Amidothionophosphonic acid ester containing plant growth regulants | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-03 | — | — | US | disclosed |