Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4061073 | 0.78 | HCAR2 (0.46) | CA1CA2MEN1KMT2APOLB | |
| SCHEMBL15864693 | 0.76 | CYP1A2 (0.41) | L3MBTL1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL30774912 | 0.76 | GPR35 (0.42) | CA1CA2TDP1CYP1A2CYP2C9 | |
| SCHEMBL690072 | 0.76 | GPR35 (0.42) | CA1CA2TDP1CYP1A2CYP2C9 | |
| SCHEMBL30997911 | 0.75 | MEN1 (0.40) | CYP1A2SMN1; SMN2MEN1KMT2AAAK1 | |
| SCHEMBL3470549 | 0.75 | CYP1A2 (0.36) | CYP1A2CASP6SMN1; SMN2MEN1KMT2A | |
| SCHEMBL3772527 | 0.75 | CYP1A2 (0.36) | CYP1A2CASP6SMN1; SMN2MEN1KMT2A | |
| SCHEMBL1716919 | 0.73 | TDP1 (0.64) | L3MBTL1CA1CA2TDP1CYP1A2 | |
| SCHEMBL1958391 | 0.72 | ALDH1A1 (0.53) | TDP1SMN1; SMN2MEN1KMT2APOLB | |
| SCHEMBL951700 | 0.72 | CYP1A2 (0.44) | TDP1CYP1A2SMN1; SMN2MEN1KMT2A |
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-109575016-A | PDE9 inhibitors and uses thereof | 南京药捷安康生物科技有限公司 | 2019-04-05 | — | — | CN | disclosed |