Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 8/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 8/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 8/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6981984 | 0.83 | CA2 (0.41) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL11475106 | 0.83 | CA2 (0.44) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL6981978 | 0.83 | CA2 (0.41) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL26304563 | 0.77 | BRD4 (0.44) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL2204596 | 0.77 | ADRA2A (0.56) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL8231332 | 0.73 | CA2 (0.41) | CA2ADRA1DADRA1AADRA1B | |
| SCHEMBL4960253 | 0.73 | CA2 (0.41) | CA2ADRA1DADRA1AADRA1B | |
| SCHEMBL4961840 | 0.72 | SLC6A2 (0.41) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL8231974 | 0.72 | SLC6A2 (0.41) | CA2ADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL6976439 | 0.71 | LMNA (0.48) | CA2POLBALDH1A1 |
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-4470989-A | Neuroleptic n-oxacyclyl-alkylpiperidine derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-09-11 | — | — | US | disclosed |
| EP-0068261-A1 | N-oxacyclyl-alkylpiperidine derivatives, their preparation, pharmaceutical preparations containing them and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-01-05 | — | — | EP | disclosed |