Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | ATP4A | P20648 | 3/20 | 0.37 |
| ▸ | ATP4B | P51164 | 3/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3433146 | 0.92 | ATP4A (0.41) | DRD2DRD3HRH3ACHEATP4A | |
| SCHEMBL3722837 | 0.91 | PIM1 (0.43) | HRH3ACHEPIM1PIM2 | |
| SCHEMBL3722601 | 0.88 | HRH3 (0.41) | DRD2DRD3HRH3ACHEPIM1 | |
| SCHEMBL3423190 | 0.86 | HRH3 (0.40) | DRD2DRD3HRH3ACHEPIM1 | |
| SCHEMBL3423184 | 0.84 | HRH3 (0.38) | DRD2DRD3HRH3ACHEPIM1 | |
| SCHEMBL674939 | 0.83 | ALK (0.39) | HRH3 | |
| SCHEMBL3432969 | 0.83 | LSS (0.42) | HRH3ACHEATP4AATP4B | |
| SCHEMBL3730838 | 0.82 | DRD3 (0.44) | DRD3HRH3ACHE | |
| SCHEMBL3426135 | 0.82 | HRH3 (0.39) | DRD2DRD3HRH3ACHEPIM1 | |
| SCHEMBL3722598 | 0.82 | ALK (0.38) | DRD2DRD3HRH3ACHEPIM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8895744-B2 | Alfa-carboline inhibitors of NPM-ALK, RET, and Bcr-Abl | UNIVERSITA' DEGLI STUDI DI MILANO-BICOCCA (IT) | 2014-11-25 | — | — | US | disclosed |
| WO-2010025872-A2 | ALFA-CARBOLINE INHIBITORS OF NPM-ALK, RET, AND BCR-ABL | UNIVERSITA' DEGLI STUDI DI MILANO-BICOCCA (IT) | 2010-03-11 | — | — | WO | disclosed |
| EP-2161271-A1 | Alpha-carboline inhibitors of NMP-ALK, RET, and Bcr-Abl | Università Degli Studi Di Milano - Bicocca (IT) | 2010-03-10 | — | — | EP | disclosed |