Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | SLC12A2 | P55011 | 1/20 | 0.34 |
| ▸ | SLC12A5 | Q9H2X9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14290873 | 0.87 | ALDH1A1 (0.39) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL4777682 | 0.87 | ALDH1A1 (0.39) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL4599439 | 0.81 | ENPP1 (0.44) | CA12MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL4599726 | 0.81 | ENPP1 (0.44) | CA12MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL6221876 | 0.80 | KMT2A (0.49) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL2098311 | 0.80 | KMT2A (0.49) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL4065055 | 0.80 | KMT2A (0.49) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL4926513 | 0.79 | SLC6A2 (0.40) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL14975403 | 0.77 | SLC12A2 (0.45) | CA12CA1CA9MEN1KMT2A | |
| SCHEMBL14975401 | 0.77 | SLC12A2 (0.45) | CA12CA1CA9MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008016811-A2 | AMINOPIPERIDINES AND REALTED COMPOUNDS | NEUROGEN CORPORATION (US) | 2008-02-07 | — | — | WO | disclosed |
| WO-2008016811-A2 | AMINOPIPERIDINES AND REALTED COMPOUNDS | NEUROGEN CORPORATION (US) | 2008-02-07 | — | — | WO | disclosed |