Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8233202 | 0.84 | ATM (0.49) | KMT2ACASP3GAAALDH1A1HSD17B10 | |
| SCHEMBL4336440 | 0.82 | CYP2D6 (0.41) | KMT2AGAAALDH1A1TDP1CYP1A2 | |
| SCHEMBL4374776 | 0.82 | CYP3A4 (0.48) | KMT2AGAAALDH1A1POLBTDP1 | |
| SCHEMBL4379672 | 0.80 | KMT2A (0.43) | KMT2AALDH1A1POLBCYP1A2CYP3A4 | |
| SCHEMBL4583744 | 0.80 | CACNA1B (0.47) | ALDH1A1CYP3A4MMP1ATM | |
| SCHEMBL4381682 | 0.78 | KMT2A (0.43) | KMT2AALDH1A1POLBCYP3A4CYP2D6 | |
| SCHEMBL13919634 | 0.77 | CTSL (0.51) | CYP3A4CYP2D6CYP2C9CYP2C19RAB9A | |
| SCHEMBL5551458 | 0.76 | PLA2G1B (0.47) | KMT2AGAAALDH1A1HSD17B10CYP3A4 | |
| SCHEMBL13919601 | 0.76 | ATM (0.49) | ATM | |
| SCHEMBL4900744 | 0.73 | ATM (0.60) | CYP3A4ATM |
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-1968568-A2 | INHIBITORS OF Akt ACTIVITY | SmithKline Beecham Corporation (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007076423-A2 | INHIBITORS OF Akt ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2007-07-05 | — | — | WO | disclosed |