Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CDC25B | P30305 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10401453 | 0.83 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1SMN1; SMN2KDM4E | |
| SCHEMBL10401452 | 0.81 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1NPSR1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9524170 | 0.80 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1NPSR1SMN1; SMN2 | |
| Iodide SCHEMBL9525393 | 0.80 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1NPSR1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9524176 | 0.80 | ALDH1A1 (0.42) | ALDH1A1HPGDEPHX1KDM4EMAPT | |
| Iodide SCHEMBL9525399 | 0.80 | ALDH1A1 (0.42) | ALDH1A1HPGDEPHX1KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL9524106 | 0.73 | ALDH1A1 (0.40) | ALDH1A1HPGDEPHX1KMT2AMEN1 | |
| SCHEMBL9526051 | 0.73 | MEN1 (0.44) | ALDH1A1HPGDNPSR1SMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL9524164 | 0.72 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1KDM4EMAPT | |
| Iodide SCHEMBL9525383 | 0.72 | ALDH1A1 (0.41) | ALDH1A1HPGDEPHX1KDM4EMAPT |
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-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |