Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.81 |
| ▸ | HPGD | P15428 | 6/20 | 0.81 |
| ▸ | HTT | P42858 | 5/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.79 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.79 |
| ▸ | LMNA | P02545 | 4/20 | 0.79 |
| ▸ | POLB | P06746 | 3/20 | 0.79 |
| ▸ | GAA | P10253 | 2/20 | 0.79 |
| ▸ | TP53 | P04637 | 1/20 | 0.79 |
| ▸ | MAPT | P10636 | 1/20 | 0.79 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.69 |
| ▸ | ATM | Q13315 | 1/20 | 0.69 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.68 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.68 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.68 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | DRD3 | P35462 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL9407621 | 0.90 | ALDH1A1 (0.84) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL4719318 | 0.87 | ALDH1A1 (0.80) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL6720867 | 0.87 | KDM4E (1.00) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL4717454 | 0.86 | ALDH1A1 (0.73) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL9407622 | 0.85 | ALDH1A1 (0.59) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL6298452 | 0.84 | ALDH1A1 (0.80) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL7540157 | 0.83 | TDP1 (0.73) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL15281339 | 0.82 | KDM4E (1.00) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL12325899 | 0.81 | KDM4E (0.91) | ALDH1A1HPGDHTTKDM4ETDP1 | |
| SCHEMBL7541377 | 0.81 | TDP1 (0.70) | ALDH1A1HPGDHTTKDM4ETDP1 |
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-6967205-B1 | Compounds with antibacterial and antiparasitic properties | NEW PHARMA RESEARCH SWEDEN AB (SE) | 2005-11-22 | — | — | US | disclosed |