Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.53 |
| ▸ | TACR1 | P25103 | 15/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.41 |
| ▸ | TACR3 | P29371 | 7/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30980992 | 0.88 | GPBAR1 (0.58) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL23361960 | 0.88 | GPBAR1 (0.58) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL337412 | 0.78 | GPBAR1 (0.54) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL336672 | 0.75 | GPBAR1 (0.51) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL336998 | 0.75 | GPBAR1 (0.77) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL30981004 | 0.75 | GPBAR1 (0.77) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL30981003 | 0.75 | GPBAR1 (0.77) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL1872308 | 0.73 | GPBAR1 (0.46) | GPBAR1 | |
| SCHEMBL1872544 | 0.73 | GPBAR1 (0.74) | GPBAR1TACR1CYP3A4TACR3 | |
| SCHEMBL336870 | 0.73 | GPBAR1 (0.48) | GPBAR1TACR1CYP3A4TACR3 |
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-2021094247-A1 | NEW CHEMICAL PROCESS FOR MAKING 6-CHLORO-4-(4-FLUORO-2-METHYLPHENYL)PYRIDIN-3-AMINE A KEY INTERMEDIATE OF NT-814 | KaNDy Therapeutics Limited (GB) | 2021-05-20 | — | — | WO | disclosed |