Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.40 |
| ▸ | HTR7 | P34969 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24309861 | 1.00 | HTR1A (0.40) | HTR1AHTR7TSHRKDM4EALDH1A1 | |
| SCHEMBL29566900 | 0.91 | HTR1A (0.43) | HTR1AHTR7TSHRKDM4EHPGD | |
| SCHEMBL24309827 | 0.91 | HTR1A (0.43) | HTR1AHTR7TSHRKDM4EHPGD | |
| SCHEMBL29566871 | 0.91 | HTR1A (0.39) | HTR1AHTR7TSHRKDM4EALDH1A1 | |
| SCHEMBL24309384 | 0.91 | HTR1A (0.39) | HTR1AHTR7TSHRKDM4EALDH1A1 | |
| SCHEMBL29566629 | 0.90 | GPR119 (0.40) | HTR1AHTR7PIK3CDPIK3CBMTOR | |
| SCHEMBL26808782 | 0.90 | GPR119 (0.40) | HTR1AHTR7PIK3CDPIK3CBMTOR | |
| SCHEMBL26811501 | 0.90 | HTR1A (0.39) | HTR1AHTR7TSHRKDM4EALDH1A1 | |
| SCHEMBL29567094 | 0.89 | HTR1A (0.38) | HTR1AHTR7TSHRKDM4EALDH1A1 | |
| SCHEMBL26808700 | 0.89 | HTR1A (0.38) | HTR1AHTR7TSHRKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |