Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.47 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | ACACB | O00763 | 1/20 | 0.45 |
| ▸ | PCNA | P12004 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | FPR2 | P25090 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4073213 | 0.85 | CYP3A4 (0.61) | ALDH1A1CYP3A4MAPK1ATMCTSL | |
| SCHEMBL4583554 | 0.85 | CYP3A4 (0.61) | ALDH1A1CYP3A4MAPK1ATMCTSL | |
| SCHEMBL11582096 | 0.83 | PCNA (0.55) | LDHAPCNAALDH1A1CYP3A4ATM | |
| SCHEMBL11582094 | 0.83 | PCNA (0.55) | LDHAPCNAALDH1A1CYP3A4ATM | |
| SCHEMBL11581174 | 0.82 | ATM (0.62) | ALDH1A1CYP3A4MAPK1ATMCTSL | |
| SCHEMBL3134015 | 0.82 | ATM (0.62) | ALDH1A1CYP3A4MAPK1ATMCTSL | |
| SCHEMBL4356408 | 0.80 | ACACB (0.58) | LDHAACACBPCNAADRB1ADRB3 | |
| SCHEMBL14370510 | 0.80 | ACACB (0.58) | LDHAACACBPCNAADRB1ADRB3 | |
| SCHEMBL18262755 | 0.80 | LDHA (0.58) | LDHAACACBADRB1ADRB3ALDH1A1 | |
| SCHEMBL20661670 | 0.80 | ATM (0.53) | CACNA1BLDHAACACBPCNAADRB1 |
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 |