Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18359320 | 0.88 | ALDH1A1 (0.64) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL18131163 | 0.87 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL12800201 | 0.85 | ALDH1A1 (0.45) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL18131168 | 0.84 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL12800060 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL6776290 | 0.81 | L3MBTL1 (0.57) | ALDH1A1L3MBTL1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL21070507 | 0.81 | MCL1 (0.53) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL19875174 | 0.80 | MITF (0.50) | ALDH1A1MCL1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL21069327 | 0.79 | MCL1 (0.42) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL21070235 | 0.79 | MCL1 (0.42) | ALDH1A1MCL1L3MBTL1SMN1; SMN2MEN1 |
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-2017004133-A1 | IRAK INHIBITORS AND USES THEREOF | NIMBUS IRIS, INC. (US) | 2017-01-05 | — | — | WO | disclosed |