Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 3/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9770393 | 0.85 | MAPT (0.64) | BACE1MAPTLMNAPOLBNPSR1 | |
| SCHEMBL9770412 | 0.85 | BACE1 (0.67) | BACE1MAPTLMNAKMT2AHSD17B10 | |
| SCHEMBL9770570 | 0.83 | BACE1 (0.76) | BACE1MAPTLMNAKMT2AHSD17B10 | |
| SCHEMBL9770562 | 0.82 | BACE1 (0.67) | BACE1MAPTLMNAMEN1KMT2A | |
| SCHEMBL9770440 | 0.81 | BACE1 (0.70) | BACE1MAPTLMNAMEN1KMT2A | |
| SCHEMBL9770399 | 0.80 | BACE1 (0.62) | BACE1MAPTLMNAHSD17B10POLB | |
| SCHEMBL9770149 | 0.79 | BACE1 (0.67) | BACE1CA1CA2CA7CA9 | |
| SCHEMBL11701711 | 0.79 | MAPT (0.64) | ESR1CA12CA1CA2CA7 | |
| SCHEMBL9369918 | 0.78 | MAPT (0.62) | ESR1CA12CA1CA2CA7 | |
| SCHEMBL13480739 | 0.77 | ADRB2 (0.57) | ESR1CA12CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0338587-A2 | Recording material | KAO CORPORATION (JP) | 1989-10-25 | — | — | EP | disclosed |