Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 2/20 | 0.62 |
| ▸ | NAMPT | P43490 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.48 |
| ▸ | GPR183 | P32249 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.48 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8404672 | 0.86 | NAMPT (0.58) | ALDH1A1POLBNAMPTMEN1KMT2A | |
| SCHEMBL19634706 | 0.86 | PARP1 (0.58) | ALDH1A1POLBMEN1KMT2AKCNH2 | |
| SCHEMBL3233139 | 0.84 | ALDH1A1 (0.65) | ALDH1A1POLBNAMPTMEN1KMT2A | |
| SCHEMBL2377318 | 0.84 | ALDH1A1 (0.69) | ALDH1A1POLBNAMPTMEN1KMT2A | |
| SCHEMBL2377726 | 0.83 | HRH3 (0.64) | POLBMEN1KMT2AHRH3CYP2D6 | |
| SCHEMBL19634738 | 0.83 | DRD3 (0.52) | MEN1KMT2ADRD2 | |
| SCHEMBL19634422 | 0.82 | MEN1 (0.49) | ALDH1A1MEN1KMT2AKCNH2GPR183 | |
| SCHEMBL3401869 | 0.81 | CYP2D6 (0.71) | ALDH1A1POLBNAMPTMEN1KMT2A | |
| SCHEMBL10211716 | 0.81 | ALDH1A1 (0.69) | ALDH1A1POLBNAMPTMEN1KMT2A | |
| SCHEMBL16299414 | 0.81 | ALDH1A1 (0.65) | ALDH1A1POLBNAMPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |