Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 10/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.43 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.42 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2447675 | 1.00 | HCRTR1 (0.48) | HCRTR1TSHRRECQLHCRTR2BCAT2 | |
| SCHEMBL2448800 | 0.91 | HCRTR1 (0.46) | HCRTR1TSHRRECQLHCRTR2MEN1 | |
| SCHEMBL2448798 | 0.91 | HCRTR1 (0.46) | HCRTR1TSHRRECQLHCRTR2MEN1 | |
| SCHEMBL2445623 | 0.88 | HCRTR1 (0.42) | HCRTR1HCRTR2MEN1KMT2AALDH1A1 | |
| SCHEMBL2445621 | 0.88 | HCRTR1 (0.42) | HCRTR1HCRTR2MEN1KMT2AALDH1A1 | |
| SCHEMBL3415640 | 0.86 | TSHR (0.46) | HCRTR1TSHRRECQLHCRTR2BCAT2 | |
| SCHEMBL2930537 | 0.86 | TSHR (0.46) | HCRTR1TSHRRECQLHCRTR2BCAT2 | |
| SCHEMBL2444048 | 0.86 | HCRTR1 (0.41) | HCRTR1TSHRHCRTR2GAAALDH1A1 | |
| SCHEMBL2444044 | 0.86 | HCRTR1 (0.41) | HCRTR1TSHRHCRTR2GAAALDH1A1 | |
| SCHEMBL2447697 | 0.82 | HCRTR1 (0.57) | HCRTR1TSHRRECQLHCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2164847-B1 | 3-AZA-BICYCLO[3.3.0]OCTANE COMPOUNDS | ACTELION PHARMACEUTICALS LTD (CH) | 2011-09-14 | — | — | EP | claimed |