Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 3/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CIT | O14578 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14291912 | 1.00 | PDE2A (0.61) | PDE2AADRB2AKT1AKT2ROCK2 | |
| SCHEMBL10124402 | 1.00 | PDE2A (0.61) | PDE2AADRB2AKT1AKT2ROCK2 | |
| SCHEMBL2693433 | 0.83 | PDE2A (0.63) | PDE2AADRB2ATMGPR35GRIA4 | |
| SCHEMBL24209319 | 0.83 | PDE2A (0.63) | PDE2AADRB2ATMGPR35GRIA4 | |
| SCHEMBL9984888 | 0.83 | PDE2A (0.63) | PDE2AADRB2ATMGPR35GRIA4 | |
| SCHEMBL13925378 | 0.83 | HIF1A (0.47) | PDE2AADRB2AKT1AKT2CYP2D6 | |
| SCHEMBL268077 | 0.81 | PDE2A (0.67) | PDE2AADRB2ROCK2ROCK1TSHR | |
| SCHEMBL335039 | 0.81 | PDE2A (0.67) | PDE2AADRB2ROCK2ROCK1TSHR | |
| SCHEMBL701658 | 0.81 | PDE2A (0.67) | PDE2AADRB2ROCK2ROCK1TSHR | |
| Hydrochloric Acid SCHEMBL14157335 | 0.81 | PDE2A (0.61) | PDE2AADRB2ROCK2ROCK1ATM |
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 |
|---|---|---|---|---|---|---|---|
| US-9802919-B1 | Compounds | CHIESI FARMACEUTICI S.P.A. (IT) | 2017-10-31 | — | — | US | disclosed |