Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | F2R | P25116 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 4/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29286662 | 0.87 | CD38 (0.46) | CD38CYP3A4KCNH2PARP1F2R | |
| Hydrochloric Acid SCHEMBL4589099 | 0.86 | CD38 (0.45) | CD38CYP3A4KCNH2PARP1F2R | |
| SCHEMBL2964481 | 0.83 | PARP1 (0.45) | CYP3A4PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL28204448 | 0.80 | PARP1 (0.50) | CD38CYP3A4KCNH2PARP1SIRT2 | |
| SCHEMBL10061561 | 0.79 | ALDH1A1 (0.41) | F2RCTSSCTSKKDM4EALDH1A1 | |
| SCHEMBL21439307 | 0.79 | MAPK8 (0.44) | CD38CYP3A4KCNH2PARP1KDM4E | |
| SCHEMBL6422087 | 0.78 | CD38 (0.41) | CD38CYP3A4KCNH2PARP1SIRT2 | |
| SCHEMBL27486467 | 0.77 | TAS2R14 (0.49) | F2RCTSSKDM4EALDH1A1P2RX7 | |
| SCHEMBL5685703 | 0.77 | ALDH1A1 (0.42) | CYP3A4PARP1KDM4EALDH1A1HPGD | |
| SCHEMBL3352032 | 0.77 | PARP1 (0.41) | CYP3A4PARP1KDM4EALDH1A1HPGD |
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-108467369-A | BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS | 诺华股份有限公司 | 2018-08-31 | — | — | CN | disclosed |