Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3364552 | 0.81 | GRM2 (0.41) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL14077454 | 0.79 | GRM2 (0.45) | ALDH1A1GRM2CA12CA9 | |
| SCHEMBL28759987 | 0.77 | GABRG2 (0.41) | PTGDR2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL27745445 | 0.76 | PTGDR2 (0.46) | PTGDR2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL3367559 | 0.76 | PRNP (0.38) | KDM4EHPGDMAPTGRM2POLB | |
| SCHEMBL3365042 | 0.75 | GRM2 (0.39) | KDM4EALDH1A1SMN1; SMN2MAPTGRM2 | |
| SCHEMBL18496493 | 0.72 | HRH4 (0.37) | KDM4EGRM2POLB | |
| SCHEMBL3364882 | 0.70 | ALDH1A1 (0.45) | KDM4EALDH1A1HPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL27615502 | 0.70 | GRM2 (0.37) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL359647 | 0.70 | LMNA (0.41) | ALDH1A1MAPTGRM2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100584830-C | Gabanergic modulators | HOFFMANN LA ROCHE LLC | 2010-01-27 | — | — | CN | disclosed |
| CN-100439341-C | indazole derivatives as corticotropin releasing factor antagonists | HOFFMANN LA ROCHE (CH) | 2008-12-03 | — | — | CN | disclosed |
| CN-1852897-A | Gamma-aminobutyric acid modulators | ROCHE PALO ALTO LLC (CH) | 2006-10-25 | — | — | CN | disclosed |
| CN-1732158-A | indazole derivatives as corticotropin releasing factor antagonists | HOFFMANN LA ROCHE (CH) | 2006-02-08 | — | — | CN | disclosed |