Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4787140 | 0.93 | POLB (0.51) | CYP3A4CYP2C19POLBLMNAHSD17B10 | |
| SCHEMBL4741026 | 0.91 | ALDH1A1 (0.52) | CYP2C19POLBLMNAKDM4EGAA | |
| SCHEMBL4739855 | 0.85 | KMT2A (0.58) | CYP3A4CYP2C19POLBMAPTLMNA | |
| SCHEMBL4740423 | 0.84 | SIRT2 (0.48) | POLBMAPTLMNAGAASMN1; SMN2 | |
| SCHEMBL4807472 | 0.83 | CYP3A4 (0.50) | CYP3A4CYP2C19POLBMAPTLMNA | |
| SCHEMBL4740080 | 0.81 | GAA (0.47) | CYP2C19POLBMAPTLMNAHSD17B10 | |
| SCHEMBL4736655 | 0.79 | HSD17B10 (0.47) | CYP2C19LMNAKDM4ETSHRHSD17B10 | |
| SCHEMBL4740909 | 0.79 | CYP2C19 (0.46) | CYP2C19HSD17B10GAAKMT2AALDH1A1 | |
| SCHEMBL4736817 | 0.75 | HTT (0.46) | CYP3A4POLBMAPTLMNATSHR | |
| SCHEMBL4739753 | 0.75 | CYP3A4 (0.68) | CYP3A4CYP2C19POLBMAPTLMNA |
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 |