Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 7/20 | 0.58 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | FLT1 | P17948 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5123545 | 0.95 | PRKCI (0.64) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL7519982 | 0.90 | MAPT (0.52) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL7609419 | 0.90 | PRKCI (0.64) | PRKCIKDM4EMAPK1ALDH1A1CNR2 | |
| SCHEMBL5812312 | 0.88 | PRKCI (0.43) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL7512040 | 0.87 | METAP1 (0.43) | PRKCIBCDIN3DPDE5AMAPTKDM4E | |
| SCHEMBL5117565 | 0.87 | PRKCI (0.48) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL5124572 | 0.86 | PRKCI (0.61) | PRKCIPDE5AMAPTNPSR1KDM4E | |
| SCHEMBL7516851 | 0.85 | PRKCI (0.41) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL5128167 | 0.85 | PRKCI (0.50) | PRKCIBCDIN3DPDE5AMAPTNPSR1 | |
| SCHEMBL5813837 | 0.85 | PRKCI (0.66) | PRKCIPDE5AKDM4EMAPK1ALDH1A1 |
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-0920431-A1 | THIENOPYRIMIDINES | MERCK PATENT GmbH (DE) | 1999-06-09 | — | — | EP | disclosed |
| WO-1998006722-A1 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 1998-02-19 | — | — | WO | disclosed |