Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDH2 | P40926 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 6/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.38 |
| ▸ | CDK1 | P06493 | 3/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3663041 | 0.83 | UCHL1 (0.44) | CCNB2CDK1CCNB1CCNB3HSD11B1 | |
| SCHEMBL6526185 | 0.83 | UCHL1 (0.44) | CCNB2CDK1CCNB1CCNB3HSD11B1 | |
| SCHEMBL31727169 | 0.76 | DRD2 (0.51) | MDH2DRD2CCNB2CDK1CCNB1 | |
| SCHEMBL30862423 | 0.75 | ACE2 (0.41) | LMNAKDM4ECHRM2HTR1AL3MBTL1 | |
| SCHEMBL932669 | 0.71 | RIPK1 (0.46) | — | |
| SCHEMBL29540420 | 0.71 | TMEM97 (0.56) | HSD11B1CHRM2L3MBTL1 | |
| SCHEMBL22721972 | 0.71 | TMEM97 (0.56) | HSD11B1CHRM2L3MBTL1 | |
| SCHEMBL29747664 | 0.70 | GCK (0.40) | CYP2D6L3MBTL1ACEACE2ALDH1A1 | |
| SCHEMBL31421713 | 0.70 | LMNA (0.47) | LMNACHRM2CYP3A4HTR1ACYP2D6 | |
| SCHEMBL10977567 | 0.68 | DRD2 (0.49) | DRD2DRD1DRD4DRD5DRD3 |
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-2240483-A1 | PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS | Array Biopharma, Inc. (US) | 2010-10-20 | — | — | EP | disclosed |
| WO-2009089454-A1 | PYRIMIDYL CYCLOPENTANES AS AKT PROTEIN KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2009-07-16 | — | — | WO | disclosed |