Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CACNA1F | O60840 | 5/20 | 0.53 |
| ▸ | CACNA1D | Q01668 | 5/20 | 0.53 |
| ▸ | CACNA1S | Q13698 | 5/20 | 0.53 |
| ▸ | CACNA1C | Q13936 | 5/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL22773398 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11507269 | 0.95 | ALDH1A1 (0.59) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL27845325 | 0.90 | TSHR (0.60) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL28067374 | 0.90 | TSHR (0.60) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11357147 | 0.88 | ALDH1A1 (0.48) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11320295 | 0.88 | ALDH1A1 (0.51) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11069758 | 0.88 | ALDH1A1 (0.51) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11359927 | 0.86 | ALDH1A1 (0.45) | ALDH1A1HSD17B10KDM4EPOLBESR1 | |
| SCHEMBL11779730 | 0.86 | RAB9A (0.56) | ALDH1A1HSD17B10POLBTSHRCACNA1F | |
| SCHEMBL7734024 | 0.86 | CACNA1F (0.58) | ALDH1A1HSD17B10KDM4EPOLBESR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4380452-A | PYRIDONE SUBSTITUTED MONOAZO DYE | BASF AKTIENGESELLSCHAFT (DE) | 1983-04-19 | — | — | US | disclosed |
| US-4305718-A | MONOAZO DISPERSE DYES | BASF AKTIENGESELLSCHAFT (DE) | 1981-12-15 | — | — | US | disclosed |
| US-4276045-A | MONOAZO DISPERSE DYES | BASF AKTIENGESELLSCHAFT (DE) | 1981-06-30 | — | — | US | disclosed |
| EP-0023315-A1 | Processes for dyeing and printing textile material containing cellulose | BASF Aktiengesellschaft (DE) | 1981-02-04 | — | — | EP | disclosed |