Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A3 | O75751 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17803800 | 0.90 | SLC22A3 (0.47) | SLC22A3ADRB2ADRB1ADRB3CACNA1H | |
| SCHEMBL680988 | 0.87 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL681325 | 0.86 | PDE2A (0.47) | CACNA1H | |
| SCHEMBL12188577 | 0.86 | SLC22A3 (0.45) | SLC22A3ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL680064 | 0.85 | PDPK1 (0.44) | ADRB2ADRB1ADRB3LMNAMAPK1 | |
| SCHEMBL2739077 | 0.85 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL681756 | 0.85 | SLC22A3 (0.44) | SLC22A3ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL17803796 | 0.83 | ADRB2 (0.41) | ADRB2ADRB1ADRB3LMNAMAPK1 | |
| SCHEMBL17803807 | 0.82 | HTR2A (0.40) | LMNAMAPK1HTTRAB9ACYP19A1 | |
| SCHEMBL681191 | 0.82 | AKT1 (0.44) | ADRB2ADRB1ADRB3LMNAMAPK1 |
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 |