Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MC4R | P32245 | 3/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MC1R | Q01726 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12168578 | 0.88 | ALDH1A1 (0.49) | ALDH1A1POLBLMNASMN1; SMN2MEN1 | |
| SCHEMBL12168576 | 0.88 | ALDH1A1 (0.49) | ALDH1A1POLBLMNASMN1; SMN2MEN1 | |
| SCHEMBL685484 | 0.86 | MC4R (0.47) | ALDH1A1POLBMEN1KMT2APAX8 | |
| SCHEMBL683581 | 0.86 | MC4R (0.47) | ALDH1A1POLBMEN1KMT2APAX8 | |
| SCHEMBL684942 | 0.84 | MC4R (0.41) | POLBPAX8MAPTGAAMC4R | |
| SCHEMBL684729 | 0.84 | MC4R (0.41) | POLBPAX8MAPTGAAMC4R | |
| SCHEMBL16151899 | 0.81 | PDE2A (0.44) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL684914 | 0.81 | PDE2A (0.44) | ALDH1A1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL16151927 | 0.81 | GAA (0.45) | ALDH1A1POLBLMNASMN1; SMN2MEN1 | |
| SCHEMBL12188472 | 0.77 | MEN1 (0.54) | ALDH1A1POLBMEN1KMT2AGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8853199-B2 | Hydroxylated and methoxylated pyrimidyl cyclopentanes as AKT protein kinase inhibitors | ARRAY BIOPHARMA, INC. (US) | 2014-10-07 | — | — | US | disclosed |