Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL17803809 | 0.87 | KEAP1 (0.37) | NPC1RAB9AKMT2ABCHEAKT1 | |
| SCHEMBL680730 | 0.86 | POLB (0.42) | POLBHDAC3HDAC1HDAC2NPC1 | |
| SCHEMBL681299 | 0.86 | AKT1 (0.43) | POLBNPC1RAB9AKMT2AAKT1 | |
| SCHEMBL681567 | 0.86 | AKT1 (0.43) | POLBNPC1RAB9AKMT2AAKT1 | |
| SCHEMBL684410 | 0.83 | CYP1A2 (0.42) | POLBHDAC3HDAC1HDAC2NPC1 | |
| SCHEMBL681257 | 0.83 | TEAD1 (0.42) | AKT1AKT2AKT3EPHX2HSD11B1 | |
| SCHEMBL680195 | 0.82 | AKT1 (0.36) | POLBHDAC3HDAC1HDAC2RAB9A | |
| SCHEMBL12194519 | 0.80 | CYP3A4 (0.40) | KMT2ACYP1A2CYP2D6 | |
| SCHEMBL2739192 | 0.80 | HDAC3 (0.40) | POLBHDAC3HDAC1HDAC2NPC1 | |
| SCHEMBL17803806 | 0.78 | LMNA (0.37) | POLBKMT2AAKT1AKT2AKT3 |
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 |