Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 6/20 | 0.43 |
| ▸ | PKLR | P30613 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4785880 | 0.91 | CYP3A4 (0.46) | CYP3A4CYP2C19PKMPKLRLMNA | |
| SCHEMBL4808038 | 0.90 | MAPT (0.48) | NPC1KDM4EMAPK1CYP3A4CYP2C19 | |
| SCHEMBL4739749 | 0.85 | CYP3A4 (0.63) | TDP1CYP3A4CYP2C19PKMLMNA | |
| SCHEMBL4738286 | 0.85 | LMNA (0.55) | NPC1KDM4EMAPK1TDP1CYP3A4 | |
| SCHEMBL4738269 | 0.84 | CYP3A4 (0.47) | NPC1KDM4EMAPK1TDP1CYP3A4 | |
| SCHEMBL4786641 | 0.82 | L3MBTL1 (0.49) | NPC1KDM4EMAPK1TDP1CYP3A4 | |
| SCHEMBL4738285 | 0.82 | CYP19A1 (0.55) | NPC1KDM4EMAPK1TDP1CYP3A4 | |
| SCHEMBL4738940 | 0.82 | ALDH1A1 (0.53) | KDM4ECYP3A4CYP2C19ALDH1A1KMT2A | |
| SCHEMBL4736822 | 0.82 | L3MBTL1 (0.45) | KDM4EMAPK1CYP3A4CYP2C19L3MBTL1 | |
| SCHEMBL4785702 | 0.82 | MAPK1 (0.52) | KDM4EMAPK1TDP1L3MBTL1LMNA |
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 |