Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HPGDS | O60760 | 1/20 | 0.36 |
| ▸ | ALKBH2 | Q6NS38 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23728312 | 1.00 | PDK2 (0.43) | PDK2MAPTKMT2AMEN1TRPA1 | |
| SCHEMBL38657390 | 0.88 | MEN1 (0.42) | PDK2MAPTKMT2AMEN1LMNA | |
| SCHEMBL23728343 | 0.83 | PDK2 (0.41) | PDK2KMT2AALDH1A1HTTRAB9A | |
| SCHEMBL23728342 | 0.83 | PDK2 (0.41) | PDK2KMT2AALDH1A1HTTRAB9A | |
| SCHEMBL25433566 | 0.75 | L3MBTL1 (0.59) | PDK2L3MBTL1PTGS2 | |
| SCHEMBL23728182 | 0.73 | KDM4C (0.40) | MAPTKMT2AMEN1TRPA1ALDH1A1 | |
| SCHEMBL23728184 | 0.73 | KDM4C (0.40) | MAPTKMT2AMEN1TRPA1ALDH1A1 | |
| SCHEMBL5172952 | 0.70 | HTT (0.40) | PDK2LMNAHTTL3MBTL1PTGS2 | |
| SCHEMBL22637482 | 0.68 | ALDH1A1 (0.48) | MAPTKMT2AMEN1TRPA1ALDH1A1 | |
| SCHEMBL22637484 | 0.68 | ALDH1A1 (0.48) | MAPTKMT2AMEN1TRPA1ALDH1A1 |
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-2021158638-A1 | ARYLAZO-HETEROARYL COMPOUNDS AND THEIR USE FOR LONG-TERM THERMAL ENERGY STORAGE | BRANDEIS UNIVERSITY (US) | 2021-08-12 | — | — | WO | disclosed |