Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6528202 | 0.96 | HTT (0.50) | HTTRAB9ATAAR1KDM4EPOLB | |
| SCHEMBL2351133 | 0.87 | KDM4E (0.57) | TAAR1KDM4EPOLBLMNATSHR | |
| Hydrochloric Acid SCHEMBL3889042 | 0.85 | KDM4E (0.55) | TAAR1KDM4EPOLBIDO1AGXT | |
| SCHEMBL465335 | 0.83 | KDM4E (0.57) | TAAR1KDM4EPOLBLMNATSHR | |
| Biphenyl-4-Amine SCHEMBL5586039 | 0.82 | CYP3A4 (0.62) | HTTRAB9ATAAR1KDM4EPOLB | |
| SCHEMBL6529404 | 0.81 | S1PR1 (0.59) | HTTRAB9AS1PR1S1PR3FFAR1 | |
| SCHEMBL9539267 | 0.79 | KDM4E (0.53) | TAAR1KDM4EPOLBLMNATSHR | |
| Felbinac SCHEMBL15067668 | 0.78 | LMNA (0.72) | HTTABCC4LMNAGAATSHR | |
| SCHEMBL6505535 | 0.77 | S1PR1 (0.55) | S1PR1S1PR3FFAR1 | |
| SCHEMBL2211080 | 0.76 | SLC6A2 (0.52) | TAAR1KDM4EPOLBS1PR1S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005014525-A2 | BI-ARYL COMPOUND HAVING IMMUNOSUPPRESSIVE ACTIVITY | MITSUBISHI PHARMA CORPORATION (JP) | 2005-02-17 | — | — | WO | claimed |