Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 10/20 | 0.44 |
| ▸ | PYGM | P11217 | 10/20 | 0.44 |
| ▸ | WDR5 | P61964 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8086877 | 0.89 | TSHR (0.45) | WDR5LMNAL3MBTL1HSD17B10TSHR | |
| SCHEMBL8080963 | 0.85 | KMT2A (0.47) | PYGLPYGMLMNAL3MBTL1TSHR | |
| SCHEMBL7981102 | 0.80 | HSD17B10 (0.64) | LMNAHSD17B10TSHRALOX15ALDH1A1 | |
| SCHEMBL8086984 | 0.76 | PYGL (0.45) | PYGLPYGMLMNAL3MBTL1ALOX15 | |
| SCHEMBL10653191 | 0.72 | PYGL (0.53) | PYGLPYGMLMNAHSD17B10TSHR | |
| SCHEMBL7275567 | 0.72 | PYGL (0.49) | PYGLPYGMLMNAHSD17B10TSHR | |
| SCHEMBL9046285 | 0.72 | KMT2A (0.45) | PYGLPYGMLMNAL3MBTL1TSHR | |
| SCHEMBL8086890 | 0.71 | NPSR1 (0.65) | WDR5LMNAHSD17B10TSHRALDH1A1 | |
| SCHEMBL9048171 | 0.70 | HSD17B10 (0.49) | HSD17B10TSHRALOX15ALDH1A1KDM4E | |
| SCHEMBL7979577 | 0.69 | KDM4E (0.62) | HSD17B10TSHRALOX15ALDH1A1KDM4E |
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-6121284-A | SPECIFIED 1-(ALKYL OR CYCLOALKYL)-2-METHYL-3-(ALKOXYCARBONYL)-4-(SUBSTITUTED PYRIDYL OR ARYL)-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE COMPOUNDS; TREATING SICKLE CELL ANEMIA, PSYCHOSES, DEPRESSION | BAYER AKTIENGESELLSCHAFT (DE) | 2000-09-19 | — | — | US | claimed |