Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.50 |
| ▸ | KDR | P35968 | 4/20 | 0.42 |
| ▸ | BRAF | P15056 | 3/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.40 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3996779 | 0.83 | FGFR2 (0.47) | KDRP2RX3FGFR2ROCK2AURKA | |
| SCHEMBL13632517 | 0.75 | GRM4 (0.46) | SMARCA2SMARCA4SCN9AGRM4 | |
| SCHEMBL3997045 | 0.74 | GRM4 (0.50) | KDRFGFR2IDO1AURKAEGFR | |
| SCHEMBL23624630 | 0.71 | TNF (0.44) | EPHX2KDRTRPA1ROCK2CYP3A4 | |
| SCHEMBL4000502 | 0.71 | MAPT (0.56) | GRM4 | |
| SCHEMBL28105814 | 0.71 | EPHX2 (0.63) | EPHX2KDRTRPA1ABL1 | |
| SCHEMBL31757616 | 0.71 | EPHX2 (0.63) | EPHX2TRPA1ABL1 | |
| SCHEMBL25069025 | 0.71 | EPHX2 (0.63) | EPHX2TRPA1ABL1 | |
| SCHEMBL27628471 | 0.70 | EPHX2 (0.51) | EPHX2TRPA1ABL1ROCK2IDO1 | |
| SCHEMBL25117247 | 0.70 | TNF (0.60) | EPHX2KDRTRPA1FGFR2AURKA |
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 |
|---|---|---|---|---|---|---|---|
| US-7622486-B2 | Pyridine compounds, process for their preparation and compositions containing them | REDDY US THERAPEUTICS, INC. (US) | 2009-11-24 | — | — | US | disclosed |