Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | 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 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 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 | |
|---|---|---|---|---|
| SCHEMBL4374642 | 0.77 | CA12 (0.42) | KMT2AMAPTMEN1RAB9AKDM4E | |
| SCHEMBL26907235 | 0.75 | CYP3A4 (0.49) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL20986716 | 0.71 | CYP3A4 (0.40) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL28905042 | 0.70 | HDAC3 (0.50) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL935057 | 0.70 | SSTR4 (0.53) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| Bicarbonate SCHEMBL28135106 | 0.69 | MAPT (0.56) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| Hydrochloric Acid SCHEMBL4323383 | 0.69 | SSTR4 (0.51) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL10749410 | 0.68 | CYP1A2 (0.49) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL29793498 | 0.67 | HDAC3 (0.47) | CYP2C19HIF1AHDAC3HDAC4HDAC1 | |
| SCHEMBL24015529 | 0.67 | CYP3A4 (0.47) | CYP2C19HIF1AHDAC3HDAC4HDAC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2117523-A1 | INHIBITORS OF AKT ACTIVITY | SmithKline Beecham Corporation (US) | 2009-11-18 | — | — | EP | disclosed |
| EP-2114388-A1 | INHIBITORS OF AKT ACTIVITY | Smithkline Beecham Corporation (US) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008098104-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-08-14 | — | — | WO | disclosed |
| WO-2008098105-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-08-14 | — | — | WO | disclosed |