Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A3 | O75751 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL679670 | 0.87 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL12188579 | 0.86 | SLC22A3 (0.45) | SLC22A3ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL2738450 | 0.85 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL681737 | 0.85 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL17803800 | 0.82 | SLC22A3 (0.47) | SLC22A3ADRB2ADRB1ADRB3 | |
| SCHEMBL680197 | 0.79 | ADRB2 (0.40) | ADRB2ADRB1ADRB3ALDH1A1KDM4E | |
| SCHEMBL681570 | 0.79 | ADRB2 (0.40) | ADRB2ADRB1ADRB3ALDH1A1KDM4E | |
| SCHEMBL681559 | 0.78 | ADRB2 (0.48) | SLC22A3ADRB2ADRB1ADRB3ALDH1A1 | |
| SCHEMBL681348 | 0.78 | MAPT (0.43) | ADRB2ADRB1ADRB3ALDH1A1KDM4E | |
| SCHEMBL12194485 | 0.78 | MAPT (0.43) | ADRB2ADRB1ADRB3ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-9359340-B2 | Hydroxylated and methoxylated pyrimidyl cyclopentanes as Akt protein kinase inhibitors | ARRAY BIOPHARMA INC. (US) | 2016-06-07 | — | — | US | disclosed |
| US-8063050-B2 | Hydroxylated and methoxylated pyrimidyl cyclopentanes as AKT protein kinase inhibitors | ARRAY BIOPHARMA INC. (US) | 2011-11-22 | — | — | US | disclosed |