Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | GLS | O94925 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL628648 | 0.76 | KDM4E (0.42) | CYP1A2ALDH1A1MAPTCYP3A4CYP2D6 | |
| SCHEMBL5209863 | 0.76 | GPR3 (0.36) | CYP1A2ALDH1A1MAPTGPR3CYP2C19 | |
| SCHEMBL5565026 | 0.74 | GPR3 (0.44) | ALDH1A1CYP3A4GPR3KDM4EHSD17B10 | |
| SCHEMBL31298641 | 0.74 | GPR3 (0.34) | CYP1A2ALDH1A1MAPTGPR3CYP2C19 | |
| SCHEMBL31172010 | 0.74 | GPR3 (0.44) | ALDH1A1CYP3A4GPR3KDM4EHSD17B10 | |
| SCHEMBL3652714 | 0.74 | GLS (0.50) | CYP1A2ALDH1A1MAPTCYP3A4CYP2D6 | |
| SCHEMBL18306868 | 0.72 | ALDH1A1 (0.50) | CYP1A2ALDH1A1MAPTCYP3A4CYP2D6 | |
| SCHEMBL14863708 | 0.71 | ELANE (0.47) | KDM4EHSD17B10ELANELMNAPOLB | |
| SCHEMBL3661464 | 0.71 | HSD17B10 (0.51) | ALDH1A1MAPTKDM4EHSD17B10KMT2A | |
| SCHEMBL2677079 | 0.71 | PDE5A (0.44) | ALDH1A1KDM4EATML3MBTL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-100369899-C | Substituted indazoles with anti-cancer activity | AVENTIS PHARMA SA (FR) | 2008-02-20 | — | — | CN | disclosed |
| CN-1642922-A | Substituted indazoles with anti-cancer activity | AVENTIS PHARMA SA (FR) | 2005-07-20 | — | — | CN | disclosed |