Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.42 |
| ▸ | SOD1 | P00441 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9770148 | 0.88 | BACE1 (0.58) | CA1CA2CA4CA7CA9 | |
| SCHEMBL9770448 | 0.87 | BACE1 (0.59) | BACE1KDM4EKMT2ARAB9AL3MBTL1 | |
| SCHEMBL9770371 | 0.85 | BACE1 (0.45) | BACE1KMT2ARAB9AADRB3HSD17B10 | |
| SCHEMBL9770474 | 0.84 | BACE1 (0.62) | BACE1KDM4EKMT2ARAB9AADRB3 | |
| SCHEMBL9770536 | 0.81 | BACE1 (0.62) | BACE1KDM4EKMT2ARAB9AL3MBTL1 | |
| SCHEMBL9770497 | 0.81 | NPC1 (0.57) | BACE1KMT2AALDH1A1RAB9AHSD17B10 | |
| SCHEMBL9770507 | 0.81 | BACE1 (0.52) | BACE1KDM4EKMT2ARAB9AADRB3 | |
| SCHEMBL9770331 | 0.81 | BACE1 (0.52) | BACE1KDM4EKMT2AALDH1A1RAB9A | |
| SCHEMBL9770535 | 0.80 | BACE1 (0.57) | BACE1KMT2AALDH1A1MAOAMAOB | |
| SCHEMBL9770500 | 0.80 | KMT2A (0.45) | CA1CA2CA4CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5071822-A | Electron donating colorless dye, electron accepting derivative of 1-(4-hydroxyphenylthio)-3-oxy-2-propanol; heat sensitive, image stability | KAO CORPORATION (JP) | 1991-12-10 | — | — | US | disclosed |