Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CTSG | P08311 | 1/20 | 0.33 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4380618 | 0.89 | ALDH1A1 (0.41) | ALDH1A1LMNAHPGDAKT1AKT2 | |
| SCHEMBL4374524 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNAHPGDCCR1SMN1; SMN2 | |
| SCHEMBL4583485 | 0.86 | ALDH1A1 (0.47) | ALDH1A1LMNAHPGDCCR1SMN1; SMN2 | |
| SCHEMBL4373508 | 0.84 | ALDH1A1 (0.42) | ALDH1A1LMNAAKT1AKT2AKT3 | |
| SCHEMBL4376938 | 0.84 | ALDH1A1 (0.44) | ALDH1A1LMNAAKT1AKT2AKT3 | |
| SCHEMBL4383634 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNAAKT1AKT2AKT3 | |
| SCHEMBL4373196 | 0.82 | ALDH1A1 (0.45) | ALDH1A1LMNASMN1; SMN2MAPT | |
| SCHEMBL4562968 | 0.81 | ALDH1A1 (0.41) | ALDH1A1LMNAAKT1AKT2AKT3 | |
| SCHEMBL4374076 | 0.81 | ALDH1A1 (0.41) | ALDH1A1LMNAAKT1AKT2AKT3 | |
| SCHEMBL4371837 | 0.80 | HTR2A (0.40) | ALDH1A1LMNAAKT1AKT2AKT3 |
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-2117523-A1 | INHIBITORS OF AKT ACTIVITY | SmithKline Beecham Corporation (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008098104-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-08-14 | — | — | WO | disclosed |