Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SAT1 | P21673 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15200275 | 1.00 | SIGMAR1 (0.40) | SIGMAR1JAK2JAK1TYK2HTR2C | |
| SCHEMBL13638689 | 1.00 | SIGMAR1 (0.40) | SIGMAR1JAK2JAK1TYK2HTR2C | |
| SCHEMBL104225 | 0.90 | — | — | |
| SCHEMBL13884246 | 0.90 | SIGMAR1 (0.45) | SIGMAR1JAK2JAK1TYK2HTR2C | |
| SCHEMBL17369631 | 0.90 | SIGMAR1 (0.45) | SIGMAR1JAK2JAK1TYK2HTR2C | |
| Hydrochloric Acid SCHEMBL21879609 | 0.87 | — | — | |
| SCHEMBL23634161 | 0.84 | SIGMAR1 (0.39) | SIGMAR1JAK2JAK1TYK2HTR2C | |
| SCHEMBL105260 | 0.82 | HTT (0.41) | SIGMAR1HTR2CHTT | |
| SCHEMBL104968 | 0.82 | — | — | |
| SCHEMBL22899465 | 0.80 | ADH1B (0.44) | SIGMAR1HTT |
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-8198458-B2 | Non-nucleoside reverse transcriptase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-06-12 | — | — | US | disclosed |