Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.54 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.54 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.54 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.54 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.54 |
| ▸ | PIK3R5 | Q8WYR1 | 2/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | STAT6 | P42226 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | NTSR1 | P30989 | 6/20 | 0.48 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7268671 | 0.88 | AURKA (0.45) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL7267813 | 0.85 | ALDH1A1 (0.70) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL7267791 | 0.82 | NPSR1 (0.52) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL7261541 | 0.81 | KDM4E (0.57) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL13675866 | 0.78 | L3MBTL1 (0.51) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| Hydrochloric Acid SCHEMBL7268677 | 0.77 | KDM4E (0.64) | ALDH1A1HPGDAURKAKDM4ESTAT6 | |
| Hydrochloric Acid SCHEMBL7266340 | 0.77 | SMN1; SMN2 (0.67) | ALDH1A1HPGDHIF1ASMN1; SMN2KDM4E | |
| SCHEMBL7262669 | 0.77 | KDM4E (0.76) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL23242448 | 0.76 | ALDH1A1 (0.63) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 | |
| SCHEMBL7268618 | 0.76 | ALDH1A1 (0.72) | ALDH1A1HPGDHIF1APIK3CDPIK3R1 |
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-6613772-B1 | Drugs such as 2-(p-chlorophenyl-4-(4-hydroxybutyl)amino-6,7,8 -trimethoxyquinazoline used for activation of guanylate cyclase and modulation of cyclic guanosine monophosphate | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2003-09-02 | — | — | US | disclosed |