Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 4/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2332852 | 0.87 | SIGMAR1 (0.46) | CFTRADRB2SIGMAR1 | |
| SCHEMBL12156845 | 0.83 | POLB (0.43) | CFTRALDH1A1KMT2ASIGMAR1 | |
| Hydrochloric Acid SCHEMBL2336425 | 0.82 | POLB (0.42) | CFTRALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL2335229 | 0.81 | SIGMAR1 (0.40) | CFTRADRB2SIGMAR1 | |
| SCHEMBL2331440 | 0.79 | SIGMAR1 (0.39) | CFTRADRB2SIGMAR1 | |
| SCHEMBL2337744 | 0.77 | MEN1 (0.42) | ALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL2331454 | 0.72 | HRH3 (0.40) | CFTR | |
| SCHEMBL2331975 | 0.71 | SMN1; SMN2 (0.48) | ADRB2ALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL2334111 | 0.70 | SIGMAR1 (0.39) | ADRB2SIGMAR1 | |
| SCHEMBL12156814 | 0.70 | SMN1; SMN2 (0.45) | CFTRADRB2KMT2ASIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8048884-B2 | Substituted piperazinyl pyrazines and pyridines as 5-HT7 receptor antagonists | ELI LILLY AND COMPANY (US) | 2011-11-01 | — | — | US | disclosed |
| EP-2188268-B1 | SUBSTITUTED PIPERAZINYL PYRAZINES AND PYRIDINES AS 5-HT7 RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2011-08-17 | — | — | EP | disclosed |