Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PKLR | P30613 | 1/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4740746 | 0.91 | CYP3A4 (0.50) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4736649 | 0.91 | CYP3A4 (0.50) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4738269 | 0.90 | CYP3A4 (0.47) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4741684 | 0.88 | ALDH1A1 (0.49) | CYP3A4CYP2C19CYP19A1ALDH1A1KMT2A | |
| SCHEMBL4737423 | 0.87 | CYP3A4 (0.65) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4782859 | 0.87 | SMN1; SMN2 (0.50) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4741112 | 0.81 | EPHX2 (0.53) | CYP3A4CYP2C19CYP19A1MAPTPOLB | |
| SCHEMBL4740391 | 0.81 | ALDH1A1 (0.47) | CYP3A4CYP2C19CYP19A1MAPTPOLB | |
| SCHEMBL4787735 | 0.81 | CYP19A1 (0.58) | CYP3A4CYP2C19CYP19A1SMN1; SMN2MAPT | |
| SCHEMBL4737612 | 0.81 | LMNA (0.50) | CYP3A4CYP2C19SMN1; SMN2ALDH1A1DPP4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008087654-A2 | PIPERIDINES AS INHIBITORS OF 11β-HYDROXYSTEROID DEHYDROGENASE TYPE 1 | CADILA HEALTHCARE LIMITED (IN) | 2008-07-24 | — | — | WO | disclosed |