Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | OGA | O60502 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GRM6 | O15303 | 2/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.34 |
| ▸ | GRM8 | O00222 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15932504 | 0.86 | OGA (0.38) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL24015540 | 0.86 | OGA (0.38) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL15932501 | 0.86 | OGA (0.38) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL22845058 | 0.85 | SMN1; SMN2 (0.33) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL17371293 | 0.84 | FGFR4 (0.39) | SMN1; SMN2NPSR1CYP2C9CYP2C19 | |
| SCHEMBL24015541 | 0.81 | CYP2C9 (0.35) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL23083835 | 0.81 | SMN1; SMN2 (0.33) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL15932498 | 0.81 | SMN1; SMN2 (0.33) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL23083773 | 0.81 | SMN1; SMN2 (0.33) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 | |
| SCHEMBL18361595 | 0.81 | PSEN1 (0.34) | SMN1; SMN2NPSR1OGACYP2C9CYP2C19 |
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-2018045385-A1 | MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF | LUMIPHORE, INC. (US) | 2018-03-08 | — | — | WO | disclosed |