Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CKS1B | P61024 | 1/20 | 0.34 |
| ▸ | SKP1 | P63208 | 1/20 | 0.34 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13904389 | 0.96 | DRD2 (0.39) | DRD2KCNA3BRD9BRD4L3MBTL1 | |
| SCHEMBL852307 | 0.80 | TSHR (0.45) | DRD2BRD9L3MBTL1KMT2ANAMPT | |
| SCHEMBL880712 | 0.78 | CCR5 (0.41) | DRD2KCNA3BRD9L3MBTL1KMT2A | |
| SCHEMBL853246 | 0.76 | CKS1B (0.39) | DRD2KCNA3BRD9BRD4L3MBTL1 | |
| SCHEMBL17874968 | 0.75 | DRD2 (0.39) | DRD2KCNA3BRD9BRD4L3MBTL1 | |
| SCHEMBL21548115 | 0.75 | KMT2A (0.36) | DRD2KCNA3BRD9BRD4L3MBTL1 | |
| SCHEMBL542496 | 0.75 | KMT2A (0.50) | DRD2BRD9L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL852155 | 0.74 | OPRM1 (0.54) | DRD2L3MBTL1KMT2AALDH1A1MAPK1 | |
| SCHEMBL550300 | 0.72 | CTSL (0.42) | KCNA3BRD4L3MBTL1KMT2ANPC1 | |
| SCHEMBL880720 | 0.72 | ALDH1A1 (0.41) | DRD2KCNA3KMT2AALDH1A1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2433937-A1 | Substituted-quinoxaline-type-piperidine compounds and the uses thereof | Purdue Pharma LP (US) | 2012-03-28 | — | — | EP | disclosed |
| EP-2433935-A1 | Substituted-quinoxaline-type-piperidine compounds and the uses thereof | Purdue Pharma LP (US) | 2012-03-28 | — | — | EP | disclosed |
| EP-2433936-A1 | Substituted-quinoxaline-type-piperidine compounds and the uses thereof | Purdue Pharma LP (US) | 2012-03-28 | — | — | EP | disclosed |