Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | VNN1 | O95497 | 1/20 | 0.49 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.49 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5752228 | 0.97 | MMP1 (0.51) | MMP1NPC1RAB9APTPN1GSK3B | |
| SCHEMBL26136120 | 0.88 | MMP1 (0.67) | MMP1NPC1RAB9APTPN1GSK3B | |
| SCHEMBL10559396 | 0.88 | NPC1 (0.67) | NPC1RAB9APTPN1SLC5A1SLC5A2 | |
| SCHEMBL3609466 | 0.85 | NPC1 (0.59) | MMP1NPC1RAB9APTPN1GSK3B | |
| SCHEMBL658098 | 0.85 | PDPK1 (0.67) | MMP1NPC1RAB9APTPN1GSK3B | |
| SCHEMBL6339735 | 0.83 | PTPN1 (0.56) | MMP1NPC1RAB9APTPN1GSK3B | |
| SCHEMBL3732779 | 0.83 | PDPK1 (0.47) | MMP1PTPN1GSK3BHDAC1HDAC8 | |
| SCHEMBL28658865 | 0.83 | NPC1 (0.66) | MMP1NPC1RAB9ACYP1A1CYP1B1 | |
| SCHEMBL26135918 | 0.80 | MMP1 (0.76) | MMP1PTPN1GSK3BHDAC1HDAC8 | |
| SCHEMBL6158144 | 0.80 | NPC1 (0.56) | NPC1RAB9APTPN1SLC5A1SLC5A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |