Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 3/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.45 |
| ▸ | HTR7 | P34969 | 2/20 | 0.45 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675856 | 0.88 | MEN1 (0.55) | MEN1KMT2AGFERNPC1KCNQ3 | |
| SCHEMBL29675508 | 0.83 | MAPK1 (0.41) | MEN1KMT2AGFERDRD2HTR1A | |
| SCHEMBL18737492 | 0.80 | DRD2 (0.51) | GFERDRD2CTSLCTSBCTSS | |
| SCHEMBL29675867 | 0.77 | MEN1 (0.45) | MEN1KMT2AGFERNPC1CTSL | |
| SCHEMBL29675519 | 0.76 | MAPK1 (0.43) | DRD2HTR1AHTR7HTR6 | |
| SCHEMBL15970178 | 0.75 | L3MBTL1 (0.53) | MEN1KMT2AGFERKCNQ3KCNQ2 | |
| SCHEMBL15970176 | 0.75 | L3MBTL1 (0.53) | MEN1KMT2AGFERKCNQ3KCNQ2 | |
| SCHEMBL306912 | 0.71 | DRD2 (0.56) | DRD2HTR1A | |
| SCHEMBL29675947 | 0.71 | ALDH1A1 (0.44) | MEN1KMT2ANPC1CYP3A4CYP2C9 | |
| SCHEMBL29676228 | 0.71 | MAPK1 (0.42) | MEN1KMT2AGFERNPC1USP2 |
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-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |