Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6529800 | 1.00 | SLC6A3 (0.31) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL6484490 | 1.00 | SLC6A3 (0.31) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL95266 | 0.95 | SLC6A3 (0.36) | SLC6A3SLC6A2SLC6A4DHFRALDH1A1 | |
| SCHEMBL3008891 | 0.76 | TACR1 (0.36) | LMNATSHR | |
| SCHEMBL5785839 | 0.75 | — | — | |
| SCHEMBL1869194 | 0.75 | — | — | |
| SCHEMBL2069121 | 0.72 | CPN1 (0.34) | — | |
| SCHEMBL1771338 | 0.70 | SLC6A2 (0.45) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL16921033 | 0.69 | SLC6A2 (0.39) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL5485976 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1664049-A1 | SYNTHESIS OF PROTECTED PYRROLOBENZODIAZEPINES | Spirogen Limited (GB) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005023814-A1 | SYNTHESIS OF PROTECTED PYRROLOBENZODIAZEPINES | SPIROGEN LIMITED (GB) | 2005-03-17 | — | — | WO | disclosed |