Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9194927 | 0.80 | SLC6A2 (0.47) | SLC6A4SLC6A2SLC6A3EPHX1SIGMAR1 | |
| SCHEMBL8094192 | 0.80 | SLC6A2 (0.47) | SLC6A4SLC6A2SLC6A3EPHX1SIGMAR1 | |
| SCHEMBL28372918 | 0.77 | SLC6A2 (0.44) | SLC6A4SLC6A2SLC6A3EPHX1SIGMAR1 | |
| SCHEMBL3128715 | 0.77 | MPO (0.42) | KDM4EL3MBTL1TSHRPKMSMN1; SMN2 | |
| SCHEMBL8379408 | 0.77 | ALDH1A1 (0.46) | MAOAKDM4EHTTNPSR1L3MBTL1 | |
| SCHEMBL11365816 | 0.75 | MAOA (0.48) | MAOAKDM4EL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL7857555 | 0.74 | SLC6A2 (0.36) | SLC6A4SLC6A2SLC6A3EPHX1SIGMAR1 | |
| SCHEMBL9457041 | 0.73 | SLC6A4 (0.42) | SLC6A4SLC6A2SLC6A3EPHX1SIGMAR1 | |
| SCHEMBL32672505 | 0.73 | TRPA1 (0.43) | MAOAKDM4EL3MBTL1MEN1KMT2A | |
| SCHEMBL32672509 | 0.73 | HRH1 (0.54) | SLC6A4SLC6A2SLC6A3TAAR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4255438-A | TREATMENT OF CARDIOVASCULAR DISEASE | CIBA-GEIGY CORPORATION (US) | 1981-03-10 | — | — | US | disclosed |