Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | TNF | P01375 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4729965 | 0.91 | HDAC6 (0.47) | HDAC6PDE10ACYP1A2TNFKMT2A | |
| SCHEMBL4729506 | 0.87 | HDAC6 (0.49) | HDAC6PDE10ACYP1A2TNFKMT2A | |
| SCHEMBL4726934 | 0.86 | HDAC6 (0.45) | HDAC6PDE10ACYP1A2TNFKMT2A | |
| SCHEMBL4729821 | 0.85 | PDE10A (0.48) | HDAC6PDE10ACYP1A2TNFKMT2A | |
| SCHEMBL4728056 | 0.83 | PDE10A (0.47) | HDAC6PDE10ACYP1A2HCRTR1HCRTR2 | |
| SCHEMBL4728780 | 0.82 | PDE10A (0.46) | HDAC6PDE10ACYP1A2HCRTR1HCRTR2 | |
| SCHEMBL4727776 | 0.79 | PDE10A (0.46) | PDE10ACYP1A2HCRTR1HCRTR2 | |
| SCHEMBL4794353 | 0.79 | PDE10A (0.46) | PDE10ACYP1A2HCRTR1HCRTR2 | |
| SCHEMBL14915051 | 0.76 | PDE10A (0.53) | PDE10AKMT2A | |
| SCHEMBL14915826 | 0.75 | PDE10A (0.54) | PDE10A |
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-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | claimed |