Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | IGF1R | P08069 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAP3K7 | O43318 | 2/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 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 | |
|---|---|---|---|---|
| SCHEMBL24310712 | 0.93 | AXL (0.33) | DRD2DRD3IGF1RHTR1ADRD4 | |
| SCHEMBL24310558 | 0.92 | IGF1R (0.31) | DRD2DRD3IGF1RPAK1 | |
| SCHEMBL24310404 | 0.92 | TACR1 (0.33) | DRD2DRD3IGF1RAXL | |
| SCHEMBL24310089 | 0.92 | DRD2 (0.35) | DRD2DRD3IGF1RNPC1HTR1A | |
| SCHEMBL24309899 | 0.91 | NPC1 (0.33) | DRD2DRD3IGF1RNPC1ALDH1A1 | |
| SCHEMBL24309539 | 0.90 | TACR1 (0.32) | DRD2DRD3IGF1R | |
| SCHEMBL24309796 | 0.90 | ALK (0.33) | DRD2DRD3IGF1REGFR | |
| SCHEMBL24309901 | 0.87 | IGF1R (0.33) | IGF1RJAK2MAP3K7MAP2K1 | |
| SCHEMBL24309916 | 0.86 | EGFR (0.39) | IGF1REGFRJAK2MAP4K1 | |
| SCHEMBL24310424 | 0.86 | PDE2A (0.41) | IGF1REGFRJAK2MAP3K7MAP4K1 |
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 |