Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 3/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL681054 | 0.89 | CYP1A2 (0.38) | KMT2ACYP1A2ALOX5SMN1; SMN2ALDH1A1 | |
| SCHEMBL681355 | 0.86 | CYP1A2 (0.38) | KMT2ACYP1A2ALOX5SMN1; SMN2MEN1 | |
| SCHEMBL679771 | 0.85 | KDM4E (0.44) | KMT2ACYP1A2ALOX5SMN1; SMN2ALDH1A1 | |
| SCHEMBL681056 | 0.83 | ALOX5 (0.42) | KMT2ACYP1A2ALOX5SMN1; SMN2ALDH1A1 | |
| SCHEMBL681357 | 0.82 | CYP1A2 (0.40) | KMT2ACYP1A2ALOX5SMN1; SMN2ALDH1A1 | |
| SCHEMBL681405 | 0.81 | ALOX5 (0.38) | KMT2ACYP1A2ALOX5SMN1; SMN2MEN1 | |
| SCHEMBL20277822 | 0.80 | CYP1A2 (0.34) | KMT2ACYP1A2ALOX5SMN1; SMN2ALDH1A1 | |
| SCHEMBL681364 | 0.80 | CYP1A2 (0.34) | CYP1A2ALOX5CNR1FPR2 | |
| SCHEMBL680831 | 0.79 | PKM (0.39) | KMT2ACYP1A2ALOX5SMN1; SMN2MEN1 | |
| SCHEMBL9679404 | 0.78 | KMT2A (0.46) | HDAC3HDAC1HDAC2KMT2ACYP1A2 |
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 |