Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.39 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29072034 | 0.98 | ZDHHC7 (0.41) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL28664768 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL28380817 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL19262293 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL18597124 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL28381502 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL18597120 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL7367485 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL22880855 | 0.83 | CA2 (0.50) | ZDHHC7CA2FAAHSMPD1GPR84 | |
| SCHEMBL8490442 | 0.81 | ZDHHC7 (0.46) | ZDHHC7CA2FAAHSMPD1GPR84 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108566-B | Substituted 2-azabicyclic compounds and their use as orexin receptor modulators | 詹森药业有限公司 | 2020-11-24 | — | — | CN | disclosed |
| CN-105308048-B | Substituted 2-azabicyclic compounds and their use as orexin receptor modulators | 詹森药业有限公司 | 2019-10-08 | — | — | CN | disclosed |
| CN-108864093-A | Substituted 2- Azabicyclic compound and their purposes as orexin receptor regulator | 詹森药业有限公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-107108566-A | Substitution 2 Azabicyclic compounds and they as orexin receptor conditioning agent purposes | 詹森药业有限公司 | 2017-08-29 | — | — | CN | disclosed |