Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2376969 | 0.84 | ATM (0.52) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL2375924 | 0.82 | ATM (0.55) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL2377505 | 0.81 | ATM (0.76) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL1979356 | 0.80 | KDM4E (0.59) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL1829614 | 0.79 | ATM (0.52) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL1830650 | 0.79 | ATM (0.52) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL619674 | 0.77 | KDM4E (0.64) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL1829468 | 0.77 | KDM4E (0.68) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL1828698 | 0.77 | ATM (0.61) | ATMKDM4EHTTL3MBTL1KMT2A | |
| SCHEMBL2375954 | 0.77 | ATM (0.65) | ATMKDM4EHTTL3MBTL1KMT2A |
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-2324032-A2 | INHIBITORS OF BETA-SECRETASE | Vitae Pharmaceuticals, Inc. (US) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010021680-A2 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS, INC. (US) | 2010-02-25 | — | — | WO | disclosed |