Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.54 |
| ▸ | NAMPT | P43490 | 2/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30206500 | 0.82 | TAAR1 (0.52) | TAAR1MEN1KMT2AMAPT | |
| SCHEMBL30206850 | 0.78 | TAAR1 (0.53) | TAAR1 | |
| SCHEMBL30206497 | 0.77 | TAAR1 (0.51) | TAAR1 | |
| SCHEMBL11520432 | 0.76 | KCNK3 (0.53) | NAMPTKCNK3NPSR1MEN1CYP1A2 | |
| SCHEMBL7606555 | 0.75 | KCNK3 (0.68) | KCNK3MEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10893771 | 0.72 | ESRRG (0.57) | KCNK3NPSR1MEN1CYP1A2CYP3A4 | |
| SCHEMBL11521614 | 0.72 | KCNK3 (0.48) | KCNK3NPSR1MEN1CYP1A2CYP3A4 | |
| SCHEMBL632594 | 0.71 | TAAR1 (0.63) | TAAR1 | |
| SCHEMBL12228168 | 0.71 | RAB9A (0.71) | NAMPTKCNK3MEN1CYP1A2CYP3A4 | |
| SCHEMBL632844 | 0.71 | TAAR1 (0.71) | TAAR1 |
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-4392412-A1 | ABAD INHIBITOR COMPOUNDS | University Court of The University of St Andrews (GB) | 2024-07-03 | — | — | EP | disclosed |
| WO-2023026060-A1 | ABAD INHIBITOR COMPOUNDS | UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) | 2023-03-02 | — | — | WO | disclosed |