Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.82 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.82 |
| ▸ | PKM | P14618 | 2/20 | 0.82 |
| ▸ | LMNA | P02545 | 1/20 | 0.82 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.82 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.59 |
| ▸ | SCN1A | P35498 | 2/20 | 0.59 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.59 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11649813 | 1.00 | ALDH1A1 (0.82) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL11807867 | 1.00 | ALDH1A1 (0.82) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11628667 | 0.98 | ALDH1A1 (0.79) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL6671584 | 0.98 | ALDH1A1 (0.79) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL6437093 | 0.93 | ALDH1A1 (0.75) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| Malonic Acid SCHEMBL7679925 | 0.92 | ALDH1A1 (0.70) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL17787861 | 0.91 | ALDH1A1 (0.68) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL12672471 | 0.91 | ALDH1A1 (1.00) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL21048464 | 0.91 | ALDH1A1 (1.00) | ALDH1A1KDM4EPKMLMNASMN1; SMN2 | |
| SCHEMBL9577143 | 0.91 | ALDH1A1 (1.00) | ALDH1A1KDM4EPKMLMNASMN1; 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-4069254-A | INHIBITORS OF BLOOD PLATELET AGGREGATION | BANYU PHARMACEUTICAL CO., LTD. (JA) | 1978-01-17 | — | — | US | disclosed |