Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | EBP | Q15125 | 1/20 | 0.37 |
| ▸ | ADH1A | P07327 | 3/20 | 0.35 |
| ▸ | ADH1C | P00326 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18909607 | 0.95 | SLC6A2 (0.33) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL15086957 | 0.79 | SIGMAR1 (0.35) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL17426068 | 0.79 | SLC6A2 (0.33) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL18909605 | 0.79 | SLC6A2 (0.33) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL18909608 | 0.78 | KDM4E (0.42) | SIGMAR1ADH1AADH1CALDH1A1 | |
| SCHEMBL18904829 | 0.77 | SLC6A2 (0.34) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL21101599 | 0.76 | SLC6A2 (0.34) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL18909624 | 0.75 | KDM4E (0.47) | SIGMAR1ADH1AADH1CKMT2AALDH1A1 | |
| SCHEMBL18909626 | 0.73 | SLC6A2 (0.30) | SLC6A2SLC6A4 | |
| SCHEMBL29952616 | 0.72 | ADH1A (0.52) | SIGMAR1TMEM97EBPADH1AADH1C |
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-2013102059-A1 | PYRAZOLO [3, 4-D] PYRIMIDINE AND PYRROLO [2, 3-D] PYRIMIDINE COMPOUNDS AS KINASE INHIBITORS | PHARMACYCLICS, INC. (US) | 2013-07-04 | — | — | WO | disclosed |