Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA3 | P07451 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA6 | P23280 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL8497308 | 1.00 | TDP1 (0.36) | TDP1DNM1HTR2AHRH1ALDH1A1 | |
| SCHEMBL2511403 | 0.89 | TDP1 (0.44) | TDP1DNM1HTR2AHRH1ALDH1A1 | |
| SCHEMBL8494019 | 0.85 | DNM1 (0.44) | TDP1DNM1HTR2AHRH1ALDH1A1 | |
| SCHEMBL8496735 | 0.85 | DNM1 (0.44) | TDP1DNM1HTR2AHRH1ALDH1A1 | |
| SCHEMBL15086048 | 0.83 | DNM1 (0.48) | DNM1ALDH1A1TSHR | |
| SCHEMBL18519801 | 0.81 | DNM1 (0.52) | DNM1ALDH1A1TSHR | |
| SCHEMBL8494447 | 0.81 | — | — | |
| SCHEMBL385017 | 0.80 | — | — | |
| SCHEMBL8493706 | 0.77 | PLA2G1B (0.34) | — | |
| SCHEMBL8491251 | 0.77 | — | — |
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-3316877-B1 | ADO-RESISTANT CYSTEAMINE ANALOGS AND USES THEREOF | HORIZON ORPHAN LLC (US) | 2019-10-30 | — | — | EP | disclosed |