Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | MARK3 | P27448 | 1/20 | 0.42 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.42 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.38 |
| ▸ | TDO2 | P48775 | 8/20 | 0.38 |
| ▸ | IDO1 | P14902 | 16/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20162427 | 0.77 | CYP11B1 (0.36) | HSP90AA1HSP90AB1IDO1CYP3A4 | |
| SCHEMBL3312128 | 0.71 | NPSR1 (0.35) | — | |
| SCHEMBL3313722 | 0.71 | NPSR1 (0.35) | — | |
| SCHEMBL3312135 | 0.71 | NPSR1 (0.35) | — | |
| SCHEMBL20162418 | 0.68 | IDO1 (0.48) | TDO2IDO1CYP3A4 | |
| SCHEMBL16730871 | 0.65 | PIM1 (0.55) | PIM1MARK3MAP4K2CAMK2BPIM3 | |
| SCHEMBL17007540 | 0.65 | LMNA (0.40) | — | |
| SCHEMBL20164006 | 0.64 | ALDH1A1 (0.43) | — | |
| SCHEMBL20164004 | 0.64 | ALDH1A1 (0.43) | — | |
| SCHEMBL29150660 | 0.64 | CD44 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3068391-B1 | ARYL LINKED IMIDAZOLE AND TRIAZOLE DERIVATIVES AND METHODS OF USE THEREOF FOR IMPROVING THE PHARMACOKINETICS OF A DRUG | MERCK SHARP & DOHME (US) | 2018-05-23 | — | — | EP | claimed |