Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CDC42 | P60953 | 1/20 | 0.43 |
| ▸ | RAC1 | P63000 | 1/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | PRNP | P04156 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5233057 | 0.86 | CA2 (0.50) | CA2KDM4EAKR1C3AKR1C2PTGS1 | |
| SCHEMBL29239834 | 0.81 | CA2 (0.57) | CA2CYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL914782 | 0.79 | BCL2L1 (0.54) | CA2KDM4EAKR1C3AKR1C2PTGS1 | |
| SCHEMBL4415170 | 0.78 | AKR1C2 (0.56) | CA2KDM4EAKR1C3AKR1C2PTGS1 | |
| SCHEMBL29020102 | 0.77 | BCL2L1 (0.53) | CA2KDM4EAKR1C3AKR1C2PTGS1 | |
| SCHEMBL5202623 | 0.77 | CA2 (0.47) | CA2KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5238184 | 0.77 | KMT2A (0.41) | CA2KDM4EDYRK1AHTTSMN1; SMN2 | |
| SCHEMBL5202024 | 0.77 | RAB9A (0.39) | CYP1A2DYRK1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5230598 | 0.77 | STING1 (0.54) | HDAC6 | |
| SCHEMBL29588973 | 0.75 | CA2 (0.49) | CA2KDM4ECYP1A2DYRK1AHTT |
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 |