Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | F12 | P00748 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL6240589 | 0.79 | TTR (0.38) | POLBHSD17B10ALDH1A1CA12CA1 | |
| SCHEMBL2896018 | 0.74 | GPR35 (0.63) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL3259550 | 0.73 | KDM4E (0.54) | GPR35HSD17B10ALDH1A1CA12CA1 | |
| Hydrochloric Acid SCHEMBL11746382 | 0.72 | GPR35 (0.61) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL5237128 | 0.71 | MAPT (0.37) | HPGDHSD17B10ALDH1A1KDM4EMAPT | |
| SCHEMBL11746375 | 0.70 | GPR35 (0.54) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL9068668 | 0.70 | GPR35 (1.00) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL19399633 | 0.70 | GPR35 (0.54) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL11684319 | 0.69 | GPR35 (0.53) | GPR35USP2POLBHPGDALOX15 | |
| SCHEMBL5230844 | 0.69 | GPR35 (0.39) | GPR35HPGDF12ALDH1A1MAPT |
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 |