Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | DUT | P33316 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4073210 | 0.84 | CYP3A4 (0.46) | NPC1RAB9AMAPTALDH1A1CYP3A4 | |
| SCHEMBL1273081 | 0.84 | CYP3A4 (0.46) | NPC1RAB9AMAPTALDH1A1CYP3A4 | |
| SCHEMBL567236 | 0.81 | NPC1 (0.47) | NPC1RAB9AMAPTSSTR4POLB | |
| SCHEMBL4595848 | 0.78 | CYP2C19 (0.41) | NPC1RAB9AMAPTALDH1A1CYP2C19 | |
| SCHEMBL4658500 | 0.78 | KDM4E (0.49) | NPC1RAB9AMAPTPOLBALDH1A1 | |
| SCHEMBL4583207 | 0.73 | CYP3A4 (0.50) | NPC1RAB9AMAPTALDH1A1CYP3A4 | |
| SCHEMBL1539491 | 0.73 | VNN1 (0.42) | RAB9APOLBMEN1KMT2ATAAR1 | |
| SCHEMBL4379160 | 0.73 | FDPS (0.46) | MAPTALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3960044 | 0.73 | RIPK1 (0.41) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL16757585 | 0.72 | CYP2C9 (0.44) | NPC1RAB9AMAPTPOLBALDH1A1 |
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-1874768-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113837-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |