Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| SCHEMBL4816617 | 0.81 | DRD2 (0.45) | POLBSMN1; SMN2DRD2TDP1EDNRB | |
| SCHEMBL4621217 | 0.79 | DRD2 (0.33) | DRD2 | |
| SCHEMBL13956545 | 0.79 | APLNR (0.45) | APLNRALDH1A1HTTSMN1; SMN2GABRA1 | |
| SCHEMBL17184765 | 0.79 | APLNR (0.36) | APLNRHTTPOLBDRD2TDP1 | |
| SCHEMBL941194 | 0.78 | DRD2 (0.40) | POLBSMN1; SMN2DRD2TDP1EDNRB | |
| SCHEMBL30393256 | 0.76 | RAB9A (0.43) | APLNRALDH1A1LMNAPOLBMAPT | |
| SCHEMBL2287094 | 0.76 | RAB9A (0.43) | APLNRALDH1A1LMNAPOLBMAPT | |
| SCHEMBL15085977 | 0.76 | APLNR (0.45) | APLNRALDH1A1HTTMAPTMAPK1 | |
| SCHEMBL6940385 | 0.76 | EDNRB (0.36) | APLNRALDH1A1DRD2MAPK1TDP1 | |
| SCHEMBL131870 | 0.75 | ALDH1A1 (0.46) | HRH4ALDH1A1HTTLMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013016720-A2 | NOVEL SUBSTITUTED BIARYLHETEROCYCLE DERIVATIVES AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER DISEASES | GERINDA THERAPEUTICS, INC. (US) | 2013-01-31 | — | — | WO | disclosed |
| EP-1896462-A2 | SUBSTITUTED BIARYLHETEROCYCLE DERIVATIVES AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER DISEASES | The Pfahl Family Trust (Dated 9 July 1996) (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006130613-A2 | SUBSTITUTED BIARYLHETEROCYCLE DERIVATIVES AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND OTHER DISEASES | THE PFAHL FAMILY TRUST (DATED 9 JULY 1996) (US) | 2006-12-07 | — | — | WO | disclosed |