Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G7 | Q13093 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25377184 | 1.00 | PLA2G7 (0.58) | PLA2G7MAPTPOLBTSHRCYP2C19 | |
| SCHEMBL2635878 | 1.00 | PLA2G7 (0.58) | PLA2G7MAPTPOLBTSHRCYP2C19 | |
| SCHEMBL2635877 | 0.89 | PLA2G7 (0.58) | PLA2G7MAPTPOLBTSHRCYP2C19 | |
| SCHEMBL25377189 | 0.89 | PLA2G7 (0.58) | PLA2G7MAPTPOLBTSHRCYP2C19 | |
| SCHEMBL92087 | 0.87 | PLA2G7 (0.57) | PLA2G7MAPTALDH1A1RAB9ALMNA | |
| SCHEMBL409974 | 0.86 | PLA2G7 (0.50) | PLA2G7MAPTPOLBTSHRHSD17B10 | |
| SCHEMBL8627827 | 0.86 | PLA2G7 (0.50) | PLA2G7MAPTPOLBTSHRHSD17B10 | |
| SCHEMBL209658 | 0.86 | PLA2G7 (0.50) | PLA2G7MAPTPOLBTSHRHSD17B10 | |
| SCHEMBL209659 | 0.86 | PLA2G7 (0.50) | PLA2G7MAPTPOLBTSHRHSD17B10 | |
| SCHEMBL73083 | 0.86 | PLA2G7 (0.50) | PLA2G7MAPTPOLBTSHRHSD17B10 |
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-2569313-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | Vertex Pharmaceuticals Incorporated (US) | 2013-03-20 | — | — | EP | disclosed |
| WO-2011143426-A1 | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-11-17 | — | — | WO | disclosed |