Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 14/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | AKT2 | P31751 | 2/20 | 0.35 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.34 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14976320 | 0.84 | AKT1 (0.48) | AKT1CNR1CNR2CYP1A2CYP3A4 | |
| SCHEMBL14975713 | 0.81 | AKT1 (0.54) | AKT1CYP1A2CYP3A4AKT2AKT3 | |
| SCHEMBL14976492 | 0.80 | CYP1A2 (0.49) | AKT1CNR1CNR2USP2ALDH1A1 | |
| SCHEMBL14976259 | 0.80 | CNR1 (0.40) | AKT1CNR1CNR2AKT2 | |
| SCHEMBL14977259 | 0.80 | AKT1 (0.46) | AKT1CNR1CNR2CYP3A4AKT2 | |
| SCHEMBL14977670 | 0.76 | AKT1 (0.44) | AKT1CNR1CNR2CYP1A2CYP3A4 | |
| SCHEMBL14975799 | 0.75 | CNR1 (0.38) | AKT1CNR1CNR2AKT2USP30 | |
| SCHEMBL14977403 | 0.75 | AKT1 (0.55) | AKT1CNR1CNR2CYP3A4AKT2 | |
| SCHEMBL14977086 | 0.75 | AKT1 (0.45) | AKT1CNR1CNR2USP2ALDH1A1 | |
| SCHEMBL14975634 | 0.74 | CNR1 (0.50) | AKT1CNR1CNR2AKT2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013078254-A1 | BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2013-05-30 | — | — | WO | disclosed |