Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7364803 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10ALOX15MAPT | |
| SCHEMBL1884748 | 0.91 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10ALOX15MAPT | |
| SCHEMBL1884750 | 0.91 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10ALOX15MAPT | |
| SCHEMBL4704851 | 0.88 | ESR1 (0.56) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL4704854 | 0.88 | ESR1 (0.56) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL1880176 | 0.83 | MAPT (0.53) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL1874354 | 0.83 | MAPT (0.53) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL1887780 | 0.83 | MAPT (0.53) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL1874352 | 0.83 | MAPT (0.53) | ALDH1A1HPGDMAPTGAAHTT | |
| SCHEMBL4702502 | 0.82 | ALDH1A1 (0.51) | ALDH1A1HPGDMAPTGAAHTT |
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-4521422-A | ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS | AMERICAN CYANAMID COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0129847-A2 | Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones | AMERICAN CYANAMID COMPANY (US) | 1985-01-02 | — | — | EP | disclosed |