Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | EIF2S1 | P05198 | 1/20 | 0.36 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1847871 | 0.87 | WDR5 (0.38) | CYP46A1ATMWDR5SMN1; SMN2NPC1 | |
| SCHEMBL12024798 | 0.81 | ATM (0.50) | CYP46A1ATMGAAKDM4EALDH1A1 | |
| SCHEMBL1854206 | 0.79 | AXL (0.47) | CYP46A1GAARAB9AKDM4EL3MBTL1 | |
| SCHEMBL3980095 | 0.75 | OPRK1 (0.47) | ATMSMN1; SMN2GAANPC1CASP3 | |
| SCHEMBL7093171 | 0.73 | AXL (0.60) | SMN1; SMN2GAAHPGDKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL7093169 | 0.71 | AXL (0.59) | SMN1; SMN2GAAHPGDKDM4EALDH1A1 | |
| SCHEMBL401530 | 0.71 | OPRK1 (0.47) | CYP46A1ATMSMN1; SMN2GAANPC1 | |
| SCHEMBL25547252 | 0.71 | GRIN2B (0.41) | CYP46A1AXL | |
| SCHEMBL645628 | 0.70 | ATM (0.44) | ATMSMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL38664726 | 0.70 | CA12 (0.50) | ATMGAAHPGDKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010017260-A1 | TRIPYRIDYL CARBOXAMIDE OREXIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2010-02-11 | — | — | WO | disclosed |