Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | LPL | P06858 | 5/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 5/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3260516 | 0.89 | MAPKAPK2 (0.50) | ALDH1A1MAPKAPK2RPS6KA3CSNK2A1PLK3 | |
| SCHEMBL29490757 | 0.77 | LPL (0.44) | LPLLIPGPRMT5WDR77CA1 | |
| SCHEMBL874992 | 0.77 | MMP12 (0.45) | EGFRLPLLIPGSNCA | |
| SCHEMBL2172654 | 0.77 | LPL (0.44) | LPLLIPGPRMT5WDR77CA1 | |
| SCHEMBL29525463 | 0.77 | MMP12 (0.45) | EGFRLPLLIPGSNCA | |
| SCHEMBL15574354 | 0.75 | ALDH1A1 (0.49) | ALDH1A1IDO1TDO2LPLLIPG | |
| SCHEMBL15296449 | 0.74 | EGFR (0.40) | ALDH1A1IDO1TDO2EGFRLPL | |
| SCHEMBL3831957 | 0.74 | PLAU (0.47) | ALDH1A1IDO1TDO2EGFRLPL | |
| SCHEMBL1226551 | 0.73 | LPL (0.42) | LPLLIPGPRMT5WDR77CA1 | |
| SCHEMBL2098959 | 0.72 | CA9 (0.50) | LPLLIPGCA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010020366-A1 | AZABICYCLIC SUBSTITUTED 5-AMINOPYRAZOLES AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-02-25 | — | — | WO | disclosed |