Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RAPGEF3 | O95398 | 3/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL733551 | 0.90 | KDR (0.44) | CASRMAPTKDM4EPDE2AGAA | |
| SCHEMBL733552 | 0.90 | KDR (0.44) | CASRMAPTKDM4EPDE2AGAA | |
| SCHEMBL1555740 | 0.90 | KDR (0.44) | CASRMAPTKDM4EPDE2AGAA | |
| Phenethylamine SCHEMBL1846723 | 0.84 | MMP7 (0.41) | CASRMAPTKDM4EGAAMAPK1 | |
| SCHEMBL1555612 | 0.79 | KDR (0.59) | CASRMAPTGAARAB9ANPSR1 | |
| SCHEMBL734816 | 0.79 | KDR (0.59) | CASRMAPTGAARAB9ANPSR1 | |
| SCHEMBL1555605 | 0.78 | SMN1; SMN2 (0.43) | MAPTKDM4EMAPK1RAB9ANPSR1 | |
| SCHEMBL19951698 | 0.78 | SMN1; SMN2 (0.43) | MAPTKDM4EMAPK1RAB9ANPSR1 | |
| SCHEMBL735574 | 0.75 | EPHX2 (0.46) | KDM4EMAPK1AKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL11329660 | 0.74 | RAPGEF3 (0.45) | CASRMAPTGAANPSR1RAPGEF3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8138175-B2 | Heterocyclyl compounds | HOFFMANN-LA ROCHE INC. (US) | 2012-03-20 | — | — | US | disclosed |