Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2557632 | 0.85 | EPHX1 (0.43) | KCNA5ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL7353766 | 0.84 | KMT2A (0.51) | KDM4EKMT2ACYP2D6 | |
| Hydrogen Sulfide SCHEMBL28029150 | 0.83 | KMT2A (0.50) | KDM4EKMT2ACYP2D6 | |
| SCHEMBL6237509 | 0.83 | FFAR1 (0.51) | ALDH1A1KDM4ENPC1MAPK1KCNH2 | |
| SCHEMBL3735688 | 0.81 | KCNA5 (0.59) | KCNA5ALDH1A1KDM4EKMT2ACYP1A2 | |
| SCHEMBL2175358 | 0.80 | KCNA5 (0.54) | KCNA5ALDH1A1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL28321278 | 0.80 | ACLY (0.48) | ALDH1A1NPC1MEN1KMT2A | |
| SCHEMBL9285273 | 0.79 | KCNA5 (0.59) | KCNA5ALDH1A1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL5956551 | 0.79 | NR4A2 (0.45) | ALDH1A1KDM4ENPC1MAPK1MEN1 | |
| SCHEMBL14810463 | 0.78 | SLC2A1 (0.48) | ALDH1A1KDM4ENPC1MAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |