Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 5/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | VCP | P55072 | 1/20 | 0.42 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5341562 | 0.89 | NR3C1 (0.49) | ALDH1A1RAB9AKDM4ENPC1NFKB1 | |
| SCHEMBL5350108 | 0.80 | GRM5 (0.47) | ALDH1A1KDM4EGRM5MAOB | |
| SCHEMBL5338540 | 0.77 | AKT1 (0.46) | ALDH1A1RAB9AKDM4EGAAGLA | |
| SCHEMBL5340690 | 0.76 | MAOB (0.40) | ALDH1A1RAB9AKDM4EGAAGLA | |
| Hydrochloric Acid SCHEMBL5344599 | 0.76 | AKT1 (0.45) | ALDH1A1RAB9AKDM4EGAAGLA | |
| SCHEMBL5346776 | 0.73 | AKT1 (0.42) | RAB9AKDM4EGAANPC1SMN1; SMN2 | |
| SCHEMBL11470852 | 0.73 | MAOB (0.46) | ALDH1A1RAB9AKDM4EGAANPC1 | |
| SCHEMBL5343644 | 0.71 | GRIN1 (0.46) | ALDH1A1RAB9AKDM4EHPGDGAA | |
| SCHEMBL5319387 | 0.71 | AKT1 (0.41) | ALDH1A1RAB9AGAANPC1SMN1; SMN2 | |
| SCHEMBL11158643 | 0.70 | CCNA2 (0.55) | ALDH1A1GAAMAOBCCNA2CDK2 |
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-2007096764-A2 | BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS | GLENMARK PHARMACEUTICALS S.A. (US) | 2007-08-30 | — | — | WO | disclosed |