Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LGALS1 | P09382 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | PRMT5 | O14744 | 12/20 | 0.52 |
| ▸ | WDR77 | Q9BQA1 | 6/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16269046 | 0.80 | LGALS1 (0.44) | LGALS1POLBMAPTHRH3ALDH1A1 | |
| SCHEMBL17687243 | 0.78 | ACKR3 (0.55) | PRMT5WDR77HRH3ALDH1A1 | |
| SCHEMBL16269416 | 0.76 | DRD2 (0.43) | LGALS1MAPTHRH3CYP2C19ALDH1A1 | |
| SCHEMBL19957637 | 0.73 | PRMT5 (0.71) | PRMT5WDR77 | |
| SCHEMBL17687180 | 0.73 | ACKR3 (0.76) | — | |
| Otx-008 SCHEMBL29423596 | 0.71 | LGALS1 (1.00) | LGALS1POLBMAPTCYP1A2CYP2D6 | |
| Otx-008 SCHEMBL28666062 | 0.71 | LGALS1 (1.00) | LGALS1POLBMAPTCYP1A2CYP2D6 | |
| SCHEMBL19178596 | 0.70 | ACKR3 (0.55) | PRMT5WDR77HRH3ALDH1A1 | |
| SCHEMBL12986625 | 0.69 | ALDH1A1 (0.57) | LGALS1POLBMAPTCYP1A2CYP2D6 | |
| SCHEMBL19957666 | 0.69 | PRMT5 (0.53) | PRMT5WDR77 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3004082-A1 | CXCR7 RECEPTOR MODULATORS | Actelion Pharmaceuticals Ltd. (CH) | 2016-04-13 | — | — | EP | claimed |
| WO-2014191929-A1 | CXCR7 RECEPTOR MODULATORS | ACTELION PHARMACEUTICALS LTD (CH) | 2014-12-04 | — | — | WO | claimed |