Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.44 |
| ▸ | HTR2C | P28335 | 4/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 12/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8452782 | 1.00 | HTR2A (0.44) | HTR2AHTR2CSIGMAR1NOTUMAKR1C3 | |
| SCHEMBL30684404 | 1.00 | HTR2A (0.44) | HTR2AHTR2CSIGMAR1NOTUMAKR1C3 | |
| SCHEMBL8454686 | 0.87 | SIGMAR1 (0.44) | HTR2AHTR2CSIGMAR1 | |
| SCHEMBL8447283 | 0.87 | HTR2A (0.49) | HTR2AHTR2CSIGMAR1NOTUMAKR1C3 | |
| SCHEMBL8449826 | 0.85 | MAPT (0.42) | HTR2AHTR2CSIGMAR1NOTUMAKR1C3 | |
| SCHEMBL8454085 | 0.85 | SIGMAR1 (0.43) | HTR2AHTR2CSIGMAR1 | |
| SCHEMBL8446846 | 0.83 | SIGMAR1 (0.46) | HTR2AHTR2CSIGMAR1 | |
| SCHEMBL3150583 | 0.80 | KDM4E (0.47) | — | |
| SCHEMBL8448530 | 0.79 | SIGMAR1 (0.42) | HTR2AHTR2CSIGMAR1 | |
| SCHEMBL8449854 | 0.79 | SIGMAR1 (0.49) | HTR2AHTR2CSIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0624586-B1 | Substituted pyrroles | HOFFMANN LA ROCHE (CH) | 1999-09-01 | — | — | EP | disclosed |
| US-5721230-A | ANTIINFLAMMATORY AGENT, VIRICIDES; TREATING CARDIOVASCULAR DISORDER, RESPIRATORY SYSTEM DISORDER, THROMBOSIS, DIABETES, ALOPECIA | HOFFMANN-LA ROCHE INC. (US) | 1998-02-24 | — | — | US | disclosed |
| EP-0624586-A1 | Substituted pyrroles | F. HOFFMANN-LA ROCHE AG (CH) | 1994-11-17 | — | — | EP | disclosed |