Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR39 | O43194 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.31 |
| ▸ | LIPE | Q05469 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310764 | 0.82 | SMN1; SMN2 (0.47) | GPR39PTGS2SMN1; SMN2LMNAMAPT | |
| SCHEMBL29566457 | 0.82 | SMN1; SMN2 (0.47) | GPR39PTGS2SMN1; SMN2LMNAMAPT | |
| SCHEMBL24309476 | 0.72 | GPR39 (0.41) | GPR39SMN1; SMN2MAPTHTTMEN1 | |
| SCHEMBL26810941 | 0.71 | LMNA (0.52) | GPR39PTGS2SMN1; SMN2LMNAMAPT | |
| SCHEMBL24309988 | 0.69 | GPR39 (0.43) | GPR39SMN1; SMN2LMNAMAPTHTT | |
| SCHEMBL26811066 | 0.64 | GPR39 (0.45) | GPR39SMN1; SMN2LMNAMAPTHTT | |
| SCHEMBL24309592 | 0.63 | NPC1 (0.37) | GPR39SMN1; SMN2LMNAMAPTHTT | |
| SCHEMBL24309956 | 0.62 | GPR39 (0.35) | GPR39MAPTHTTMEN1KMT2A | |
| SCHEMBL24310012 | 0.59 | TSHR (0.46) | GPR39SMN1; SMN2LMNAMAPTNPSR1 | |
| SCHEMBL29566878 | 0.59 | TSHR (0.46) | GPR39SMN1; SMN2LMNAMAPTNPSR1 |
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-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |