Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 2/20 | 0.61 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | CA5A | P35218 | 2/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA3 | P07451 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9849401 | 0.84 | DAO (0.50) | DAOMAOBMAOAKDM4EMCL1 | |
| SCHEMBL14126856 | 0.82 | DAO (0.47) | DAOMAOBMAOAKDM4EMCL1 | |
| SCHEMBL28863034 | 0.81 | DAO (0.46) | DAOMAOBMAOAKDM4EMCL1 | |
| SCHEMBL30086987 | 0.81 | DAO (0.62) | DAOKDM4EMCL1IDO1ALDH1A1 | |
| SCHEMBL1372897 | 0.81 | DAO (0.62) | DAOKDM4EMCL1IDO1ALDH1A1 | |
| SCHEMBL10714152 | 0.81 | IDO1 (0.49) | DAOMAOBMAOAKDM4EMCL1 | |
| SCHEMBL10671761 | 0.80 | ALDH1A1 (0.54) | DAOKDM4EALDH1A1TSHRHPGD | |
| Hydrochloric Acid SCHEMBL1373614 | 0.79 | DAO (0.60) | DAOKDM4EMCL1ALDH1A1CA12 | |
| SCHEMBL16627573 | 0.78 | MCL1 (0.46) | DAOMAOBMAOAKDM4EMCL1 | |
| SCHEMBL16627568 | 0.78 | CA12 (0.51) | DAOKDM4EMCL1ALDH1A1CA12 |
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-0446604-A2 | Pyridine and related aza heterocycle derivatives as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1991-09-18 | — | — | EP | disclosed |