Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | TNKS | O95271 | 8/20 | 0.61 |
| ▸ | TNKS2 | Q9H2K2 | 8/20 | 0.61 |
| ▸ | PARP1 | P09874 | 5/20 | 0.61 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.55 |
| ▸ | GUSB | P08236 | 7/20 | 0.54 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6695759 | 0.81 | TNKS2 (0.81) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL12758425 | 0.80 | ALDH1A1 (0.73) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL29941412 | 0.77 | NPC1 (0.62) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL546102 | 0.77 | NPC1 (0.62) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL6885282 | 0.76 | TNKS (0.93) | ALDH1A1NPC1RAB9ATNKSTNKS2 | |
| SCHEMBL258433 | 0.76 | TNKS (1.00) | ALDH1A1NPC1RAB9ATNKSTNKS2 | |
| SCHEMBL29592833 | 0.76 | TNKS (1.00) | ALDH1A1NPC1RAB9ATNKSTNKS2 | |
| SCHEMBL29764050 | 0.76 | NPC1 (1.00) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL10709261 | 0.76 | NPC1 (1.00) | ALDH1A1NPC1RAB9ALMNAGAA | |
| SCHEMBL21843249 | 0.76 | ALDH1A1 (0.63) | ALDH1A1NPC1RAB9ALMNAGAA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114621194-B | 4-methylene-N-hydroxybenzoamide compound and application thereof | 沈阳药科大学 | 2023-08-29 | — | — | CN | disclosed |
| CN-114621194-B | 4-methylene-N-hydroxybenzoamide compound and application thereof | 沈阳药科大学 | 2023-08-29 | — | — | CN | disclosed |
| CN-114621194-A | 4-methylene-N-hydroxybenzamide compound and application thereof | 沈阳药科大学 | 2022-06-14 | — | — | CN | disclosed |
| EP-3154961-A1 | QUINAZOLINONE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | Gilead Sciences, Inc. (US) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015191743-A1 | QUINAZOLINONE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2015-12-17 | — | — | WO | disclosed |