Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | HTT | P42858 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.45 |
| ▸ | NPY2R | P49146 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | FLT4 | P35916 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4740406 | 0.92 | ALDH1A1 (0.44) | KMT2AHTTLMNAGAAMEN1 | |
| SCHEMBL4740126 | 0.86 | CCR1 (0.44) | MAPTHTTLMNANPSR1FLT1 | |
| SCHEMBL4741276 | 0.84 | TSHR (0.41) | KMT2AMAPTHTTLMNANPSR1 | |
| SCHEMBL4795192 | 0.83 | CYP3A4 (0.55) | CYP3A4CYP2C19KMT2AMAPTHTT | |
| SCHEMBL4739855 | 0.81 | KMT2A (0.58) | CYP3A4CYP2C19KMT2AMAPTHTT | |
| SCHEMBL4740909 | 0.76 | CYP2C19 (0.46) | CYP2C19KMT2AGAAMEN1HSD17B10 | |
| SCHEMBL4740080 | 0.76 | GAA (0.47) | CYP2C19MAPTHTTLMNAGAA | |
| SCHEMBL4787140 | 0.76 | POLB (0.51) | CYP3A4CYP2C19KMT2ALMNAGAA | |
| SCHEMBL4807466 | 0.75 | CYP3A4 (0.54) | CYP3A4CYP2C19KMT2AMAPTHTT | |
| SCHEMBL4741026 | 0.74 | ALDH1A1 (0.52) | CYP2C19KMT2ALMNAGAAMEN1 |
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 |