Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 5/20 | 0.35 |
| ▸ | NOS3 | P29474 | 4/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 3/20 | 0.33 |
| ▸ | CCR8 | P51685 | 3/20 | 0.33 |
| ▸ | CCR5 | P51681 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | PLAU | P00749 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4387727 | 0.75 | NOS2 (0.54) | NOS2NOS3NOS1CCR1CCR8 | |
| SCHEMBL20135885 | 0.74 | ALDH1A1 (0.50) | NOS2NOS3NOS1CCR1CCR8 | |
| SCHEMBL570133 | 0.74 | — | — | |
| SCHEMBL2085241 | 0.74 | NOS2 (0.46) | NOS2NOS3CCR1CCR8CCR5 | |
| SCHEMBL29426573 | 0.74 | — | — | |
| SCHEMBL3340081 | 0.73 | NOS3 (0.42) | NOS2NOS3NOS1CCR1CCR8 | |
| SCHEMBL8688305 | 0.71 | KDM4C (0.39) | NOS2NOS3CCR1CCR8CCR5 | |
| SCHEMBL3716910 | 0.71 | CCR1 (0.35) | NOS2NOS3CCR1CCR8CCR5 | |
| SCHEMBL20767182 | 0.71 | CCR1 (0.35) | NOS2NOS3CCR1CCR8CCR5 | |
| SCHEMBL12468608 | 0.71 | CCR1 (0.35) | NOS2NOS3CCR1CCR8CCR5 |
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-2970207-B1 | SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-05-16 | — | — | EP | claimed |