Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.47 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.46 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.46 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.46 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.46 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.46 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9587344 | 1.00 | HDAC1 (0.50) | HDAC1HTR2CPDK1PDK2PDK3 | |
| SCHEMBL5097657 | 0.86 | NPSR1 (0.46) | HTR2CPDK1PDK2PDK3PDK4 | |
| SCHEMBL25701952 | 0.84 | HDAC1 (0.46) | HDAC1HTR2CPDK1PDK2PDK3 | |
| SCHEMBL4534787 | 0.84 | AGTR2 (0.50) | HDAC1HTR2CPDK1PDK2PDK3 | |
| SCHEMBL25701954 | 0.83 | AGTR2 (0.47) | HDAC1HTR2CAGTR2PSEN1PSEN2 | |
| SCHEMBL2282075 | 0.80 | HTR2C (0.52) | HTR2CPDK1PDK2PDK3PDK4 | |
| SCHEMBL5097684 | 0.79 | NPC1 (0.51) | HTR2CAGTR2PSEN1PSEN2APH1B | |
| SCHEMBL5517082 | 0.78 | HTR2C (0.64) | HDAC1HTR2CPDK1PDK2PDK3 | |
| SCHEMBL5517077 | 0.78 | HTR2C (0.64) | HDAC1HTR2CPDK1PDK2PDK3 | |
| SCHEMBL10053573 | 0.78 | HTR2C (0.64) | HDAC1HTR2CPDK1PDK2PDK3 |
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-5036153-A | Preparation of 2,5-diazabicyclo[2.2.1]heptanes and intermediates | PFIZER INC., A CORP. OF DE | 1991-07-30 | — | — | US | disclosed |