Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.42 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.42 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | JUND | P17535 | 1/20 | 0.40 |
| ▸ | FOSB | P53539 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 6/20 | 0.37 |
| ▸ | CDK9 | P50750 | 6/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL21081177 | 0.79 | TRPC6 (0.44) | HTR2CHTR2AJUNDFOSBTGFBR1 | |
| Hydrochloric Acid SCHEMBL21045773 | 0.78 | HTR2C (0.45) | HTR2CHTR2AJUNDFOSBTGFBR1 | |
| Hydrochloric Acid SCHEMBL30439853 | 0.78 | HTR2C (0.45) | HTR2CHTR2AJUNDFOSBTGFBR1 | |
| SCHEMBL23047411 | 0.75 | HTR2C (0.48) | HTR2CEHMT2EHMT1HTR2ACCNT1 | |
| SCHEMBL24542800 | 0.67 | TRPC6 (0.46) | HTR2A | |
| SCHEMBL21288252 | 0.67 | GLS (0.41) | HTR2C | |
| SCHEMBL24542600 | 0.66 | TRPC6 (0.48) | — | |
| SCHEMBL5584988 | 0.66 | TGFBR1 (0.56) | HTR2CHTR2ATGFBR1ACVR1PDE4B | |
| SCHEMBL24542801 | 0.66 | PDE10A (0.37) | HTR2CHTR2A | |
| SCHEMBL30607144 | 0.66 | TRPC6 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3786160-A1 | PYRIDINE DERIVATIVES AND THERAPEUTIC USES THEREOF AS TRPC6 INHIBITORS | Boehringer Ingelheim International GmbH (DE) | 2021-03-03 | — | — | EP | disclosed |