Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | USP7 | Q93009 | 3/20 | 0.33 |
| ▸ | BACE1 | P56817 | 7/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 3/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.30 |
| ▸ | CCR5 | P51681 | 1/20 | 0.30 |
| ▸ | CCR8 | P51685 | 1/20 | 0.30 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29496187 | 0.89 | FGFR1 (0.35) | USP7PTGS1PTGS2CCR1CCR5 | |
| SCHEMBL29496138 | 0.89 | USP7 (0.33) | PDE10AUSP7CCR1CCR5CCR8 | |
| Hydrochloric Acid SCHEMBL29496160 | 0.87 | BACE1 (0.33) | PDE10AUSP7BACE1BACE2CYP3A4 | |
| SCHEMBL29496143 | 0.87 | PDPK1 (0.34) | USP7BACE1BACE2CTSD | |
| SCHEMBL29496273 | 0.86 | USP7 (0.32) | USP7BACE1PTGS1PTGS2CTSD | |
| SCHEMBL24671049 | 0.83 | FGFR1 (0.35) | BACE1BACE2CYP3A4CYP2D6CTSD | |
| SCHEMBL29495873 | 0.83 | FGFR1 (0.35) | BACE1BACE2CYP3A4CYP2D6CTSD | |
| SCHEMBL29496209 | 0.82 | FGFR1 (0.32) | USP7 | |
| SCHEMBL22969595 | 0.81 | REN (0.39) | PDE10AUSP7BACE1BACE2CYP3A4 | |
| SCHEMBL29495834 | 0.81 | REN (0.39) | PDE10AUSP7BACE1BACE2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114269730-A | 5-heteroaryl-pyridin-2-amine compounds as neuropeptide FF receptor antagonists | 多曼治疗学公司 | 2022-04-01 | — | — | CN | disclosed |