Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 4/20 | 0.41 |
| ▸ | AKT2 | P31751 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 8/20 | 0.33 |
| ▸ | TP53 | P04637 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14975461 | 0.86 | AKT1 (0.43) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14976175 | 0.86 | CNR1 (0.44) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14976132 | 0.85 | AKT1 (0.44) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14976448 | 0.83 | AKT1 (0.43) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14977463 | 0.82 | ROCK2 (0.42) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14975616 | 0.81 | AKT1 (0.43) | AKT1AKT2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL14977316 | 0.80 | AKT1 (0.47) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14976259 | 0.80 | CNR1 (0.40) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14977671 | 0.79 | AKT1 (0.45) | AKT1AKT2CNR1CNR2KIT | |
| SCHEMBL14977162 | 0.79 | AKT1 (0.45) | AKT1AKT2CNR1CNR2KIT |
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 |