Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MB | P02144 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.33 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4405781 | 0.88 | PDE3B (0.39) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL4399635 | 0.82 | PDE3B (0.51) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL1519700 | 0.79 | SMYD3 (0.51) | PDE3BPDE3AHDAC3SMYD3 | |
| SCHEMBL31032797 | 0.78 | PDE3B (0.54) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL5366326 | 0.78 | PDE3B (0.54) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL16548893 | 0.77 | PDE3B (0.60) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL4397712 | 0.75 | CYP11B1 (0.44) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL9196020 | 0.73 | ALDH1A1 (0.54) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL4394150 | 0.73 | PDE3B (0.49) | PDE3BPDE3ACYP11B1CYP11B2CRBN | |
| SCHEMBL18114133 | 0.73 | PDE3B (0.49) | PDE3BPDE3ACYP11B1CYP11B2CRBN |
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 |
|---|---|---|---|---|---|---|---|
| EP-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |