Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.48 |
| ▸ | CLK1 | P49759 | 1/20 | 0.43 |
| ▸ | NCS1 | P62166 | 1/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.40 |
| ▸ | CSNK1D | P48730 | 5/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL5229957 | 0.84 | DYRK1A (0.42) | DYRK1ACLK1NCS1HDAC6CSNK1D | |
| SCHEMBL5234051 | 0.81 | DYRK1A (0.44) | DYRK1ACLK1HDAC6CHRNA7HTR3A | |
| SCHEMBL27946277 | 0.80 | CLK1 (0.41) | DYRK1ACLK1NCS1CFTRHDAC6 | |
| SCHEMBL5239202 | 0.79 | CYP2A6 (0.50) | DYRK1ACLK1HDAC6CHRNA7HTR3A | |
| SCHEMBL2895393 | 0.78 | CLK1 (0.52) | DYRK1ACLK1NCS1CFTRHDAC6 | |
| SCHEMBL29430298 | 0.78 | CLK1 (0.52) | DYRK1ACLK1NCS1CFTRHDAC6 | |
| SCHEMBL5229048 | 0.78 | LMNA (0.50) | DYRK1ACLK1HDAC6MEN1KMT2A | |
| SCHEMBL15698892 | 0.75 | POLB (0.56) | DYRK1ACLK1HDAC6CHRNA7HTR3A | |
| SCHEMBL5198179 | 0.75 | HDAC3 (0.49) | DYRK1AHDAC6CYP1A2 | |
| SCHEMBL5179222 | 0.74 | DYRK1A (0.45) | DYRK1ACLK1PPARA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1461335-B1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1461335-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | Bayer HealthCare AG (DE) | 2004-09-29 | — | — | EP | disclosed |
| WO-2003055878-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2003-07-10 | — | — | WO | disclosed |