Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL681357 | 0.85 | CYP1A2 (0.40) | CYP1A2ALOX5MAPTPOLBCNR1 | |
| SCHEMBL17803819 | 0.85 | KDM4E (0.42) | CYP1A2POLBCNR1SMN1; SMN2KDM4E | |
| SCHEMBL12194485 | 0.84 | MAPT (0.43) | CYP1A2MAPTPOLBKDM4ELMNA | |
| SCHEMBL681348 | 0.84 | MAPT (0.43) | CYP1A2MAPTPOLBKDM4ELMNA | |
| SCHEMBL12188508 | 0.83 | CYP1A2 (0.45) | CYP1A2ALOX5MAPTPOLBCNR1 | |
| SCHEMBL681418 | 0.82 | ALDH1A1 (0.36) | CYP1A2ALOX5MAPTCNR1NPSR1 | |
| SCHEMBL2738685 | 0.82 | ALOX5 (0.46) | CYP1A2ALOX5MAPTPOLBCNR1 | |
| SCHEMBL680223 | 0.80 | ALOX5 (0.42) | CYP1A2ALOX5SMN1; SMN2 | |
| SCHEMBL681240 | 0.79 | ALOX5 (0.41) | CYP1A2ALOX5MAPTCNR1SMN1; SMN2 | |
| SCHEMBL681301 | 0.77 | ALOX5 (0.31) | CYP1A2ALOX5POLB |
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 |