Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CTSA | P10619 | 2/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TSPO | P30536 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9030025 | 0.87 | GPBAR1 (0.38) | GPBAR1 | |
| SCHEMBL8745917 | 0.84 | HPGD (0.41) | ROCK2NPC1TSHRRAB9AHPGD | |
| SCHEMBL8327839 | 0.82 | TSHR (0.36) | NPC1TSHRRAB9AKDM4EGAA | |
| SCHEMBL8550618 | 0.77 | LIPE (0.43) | GPBAR1KDM4E | |
| SCHEMBL8549639 | 0.77 | GPBAR1 (0.37) | GPBAR1TSPO | |
| SCHEMBL9027971 | 0.73 | CRHR1 (0.37) | ROCK2HPGDHSD17B10CTSALPAR1 | |
| SCHEMBL8326882 | 0.73 | MAPT (0.40) | NPC1GPBAR1GAA | |
| SCHEMBL8745909 | 0.73 | ITGB1 (0.37) | GPBAR1CTSAKDM4EGAA | |
| SCHEMBL27437030 | 0.72 | LIPE (0.33) | GPBAR1CTSA | |
| SCHEMBL8550007 | 0.72 | CTSA (0.33) | ROCK2CTSA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0695292-A1 | HERBICIDAL (4-SUBSTITUTED PYRIDYL)-3-CARBINOLS | ZENECA LIMITED (GB) | 1996-02-07 | — | — | EP | disclosed |