Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6974041 | 0.77 | SLC6A3 (0.35) | SLC6A3SLC6A2SLC6A4DHFRTDP1 | |
| Trifluoroacetic Acid SCHEMBL6973149 | 0.70 | DPP4 (0.36) | SLC6A3SLC6A2SLC6A4DHFRTDP1 | |
| SCHEMBL11743677 | 0.64 | KMT2A (0.50) | TDP1ALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL19141026 | 0.62 | SLC6A3 (0.72) | SLC6A3SLC6A2SLC6A4DHFRTDP1 | |
| SCHEMBL23109282 | 0.62 | SLC6A3 (0.72) | SLC6A3SLC6A2SLC6A4DHFRTDP1 | |
| SCHEMBL1357640 | 0.62 | KDM4E (0.50) | SLC6A4TDP1ALDH1A1LMNATSHR | |
| SCHEMBL8431549 | 0.62 | KDM4E (0.50) | SLC6A4TDP1ALDH1A1LMNATSHR | |
| SCHEMBL8432973 | 0.62 | KDM4E (0.50) | SLC6A4TDP1ALDH1A1LMNATSHR | |
| SCHEMBL8670434 | 0.62 | KDM4E (0.50) | SLC6A4TDP1ALDH1A1LMNATSHR | |
| SCHEMBL264411 | 0.60 | KDM4E (0.45) | TDP1ALDH1A1LMNATSHRKDM4E |
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-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | claimed |