Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9198335 | 0.84 | CYP2A6 (0.47) | CYP2A6DYRK1AMEN1MAPTKMT2A | |
| SCHEMBL5233617 | 0.83 | CYP2A6 (0.53) | CYP2A6DYRK1AMEN1MAPTKMT2A | |
| SCHEMBL5234051 | 0.83 | DYRK1A (0.44) | DYRK1AMEN1MAPTKMT2AHDAC6 | |
| SCHEMBL5229048 | 0.83 | LMNA (0.50) | DYRK1AMEN1KMT2AHDAC6NPC1 | |
| SCHEMBL5198179 | 0.80 | HDAC3 (0.49) | CYP2A6DYRK1AHDAC3HDAC4HDAC1 | |
| SCHEMBL5179222 | 0.79 | DYRK1A (0.45) | DYRK1ACLK1DYRK1B | |
| SCHEMBL5235708 | 0.79 | DYRK1A (0.48) | DYRK1AMEN1KMT2AHDAC6CHRNA7 | |
| SCHEMBL5231561 | 0.78 | SMN1; SMN2 (0.62) | DYRK1AMEN1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL826722 | 0.77 | CYP2A6 (0.52) | CYP2A6DYRK1AMEN1MAPTKMT2A | |
| SCHEMBL5237648 | 0.75 | STING1 (0.49) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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 |