Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 2/20 | 0.35 |
| ▸ | SORD | Q00796 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2468108 | 0.78 | KDM4E (0.43) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL615439 | 0.76 | KDM4E (0.47) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL615831 | 0.75 | KDM4E (0.46) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL616736 | 0.73 | KDM4E (0.44) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL13353997 | 0.73 | KDM4E (0.44) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL617697 | 0.71 | MAPT (0.41) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL15972437 | 0.71 | KDM4E (0.52) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL615442 | 0.70 | KDM4E (0.41) | KDM4EALDH1A1MAPTHSD17B10PTPN11 | |
| SCHEMBL617336 | 0.69 | KDM4E (0.46) | KDM4EALDH1A1MAPTHSD17B10KMT2A | |
| SCHEMBL617337 | 0.69 | KDM4E (0.46) | KDM4EALDH1A1MAPTHSD17B10KMT2A |
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-2370424-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | Vertex Pharmaceuticals Incorporated (US) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010054398-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-05-14 | — | — | WO | disclosed |