Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.34 |
| ▸ | DRD1 | P21728 | 3/20 | 0.34 |
| ▸ | DRD4 | P21917 | 3/20 | 0.34 |
| ▸ | DRD5 | P21918 | 3/20 | 0.34 |
| ▸ | DRD3 | P35462 | 3/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13738835 | 0.83 | MEN1 (0.35) | DRD2BRD4OPRM1OPRD1OPRK1 | |
| SCHEMBL28053542 | 0.81 | PROKR1 (0.39) | ALDH1A1 | |
| Formic Acid SCHEMBL27516069 | 0.78 | PTGDR2 (0.38) | BRD4OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL12954599 | 0.77 | PNMT (0.40) | OPRM1OPRD1OPRK1OPRL1HTR2A | |
| SCHEMBL3750890 | 0.77 | SLC6A2 (0.40) | OPRM1OPRD1OPRK1OPRL1HTR1B | |
| Hydrochloric Acid SCHEMBL3756190 | 0.76 | SLC6A2 (0.39) | OPRM1OPRD1OPRK1OPRL1HTR1B | |
| SCHEMBL3745489 | 0.76 | PTGDR2 (0.42) | OPRM1OPRD1OPRK1OPRL1HTR1B | |
| Hydrochloric Acid SCHEMBL15921931 | 0.76 | SLC6A2 (0.39) | HTR2A | |
| SCHEMBL11194756 | 0.75 | HRH1 (0.38) | DRD2DRD1DRD4DRD3PDE4B | |
| Hydrochloric Acid SCHEMBL13268822 | 0.74 | PTGDR2 (0.41) | OPRM1OPRD1OPRK1OPRL1HTR2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105452233-B | Piperidine and azepane derivatives as prokineticin receptor modulators | 武田药品工业株式会社 | 2017-12-08 | — | — | CN | claimed |
| CN-105452233-A | Piperidine and azepane derivatives as prokineticin receptor modulators | TAKEDA PHARMACEUTICALS CO | 2016-03-30 | — | — | CN | claimed |
| CN-105452233-B | Piperidine and azepane derivatives as prokineticin receptor modulators | 武田药品工业株式会社 | 2017-12-08 | — | — | CN | disclosed |
| CN-105452233-A | Piperidine and azepane derivatives as prokineticin receptor modulators | TAKEDA PHARMACEUTICALS CO | 2016-03-30 | — | — | CN | disclosed |