Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | GLS | O94925 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3532632 | 0.76 | GPR3 (0.36) | GPR3CYP1A2CYP2C19KDM4EATM | |
| SCHEMBL5209863 | 0.76 | GPR3 (0.36) | GPR3CYP1A2CYP2C19KDM4EATM | |
| SCHEMBL30599479 | 0.74 | GLS (0.50) | GPR3KDM4EHSD17B10ALDH1A1GLS | |
| SCHEMBL31172010 | 0.74 | GPR3 (0.44) | GPR3KDM4EHSD17B10ALDH1A1GLS | |
| SCHEMBL5565026 | 0.74 | GPR3 (0.44) | GPR3KDM4EHSD17B10ALDH1A1GLS | |
| SCHEMBL31298641 | 0.74 | GPR3 (0.34) | GPR3CYP1A2CYP2C19KDM4EATM | |
| SCHEMBL2677079 | 0.71 | PDE5A (0.44) | KDM4EATML3MBTL1ALDH1A1 | |
| SCHEMBL29805461 | 0.70 | HTR3A (0.42) | HSD17B10GLS | |
| SCHEMBL14158377 | 0.69 | PDE5A (0.41) | GPR3CYP1A2CYP2C19KDM4EATM | |
| SCHEMBL19204838 | 0.69 | MEN1 (0.32) | ALDH1A1PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105658640-A | Alkynyl alcohols and methods of use | 豪夫迈·罗氏有限公司 | 2016-06-08 | — | — | CN | disclosed |