Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | NEK2 | P51955 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4349748 | 0.80 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL4350463 | 0.76 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL10012799 | 0.75 | HSD11B1 (0.46) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL4944318 | 0.75 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL4345607 | 0.75 | ALDH1A1 (0.76) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL8627702 | 0.75 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL2889816 | 0.74 | KDM4E (0.52) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL30523900 | 0.71 | MEN1 (0.44) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL4559681 | 0.71 | MEN1 (0.44) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL3352182 | 0.70 | KMT2A (0.72) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A |
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-2009094205-A2 | 3-ARYL-6-ARYL-7H-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZINES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF | CYTOVIA, INC. (US) | 2009-07-30 | — | — | WO | disclosed |