Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.54 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9509221 | 1.00 | CRHBP (0.54) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL4301791 | 0.88 | CRHBP (0.56) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL1700747 | 0.88 | CRHBP (0.53) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL1700749 | 0.88 | CRHBP (0.53) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL8742128 | 0.88 | CRHBP (0.56) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL21728986 | 0.88 | CRHBP (0.53) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL6129749 | 0.85 | CRHBP (0.57) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL21626406 | 0.85 | CRHBP (0.57) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL6129750 | 0.85 | CRHBP (0.57) | CRHBPCRHR2MAPTTDP1HTT | |
| SCHEMBL3584166 | 0.85 | CRHBP (0.51) | CRHBPCRHR2MAPTTDP1HTT |
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-2009151972-A1 | SMALL MOLECULE INHIBITORS OF BOTULINUM NEUROTOXINS | , THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE ARMY, ON BEHALF OF U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND (US) | 2009-12-17 | — | — | WO | disclosed |