Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25396428 | 0.80 | TRPV4 (0.34) | CYP11B2CYP11B1TRPV4MAOAMAOB | |
| SCHEMBL28055060 | 0.78 | TRPV4 (0.33) | CYP11B2CYP11B1TRPV4 | |
| SCHEMBL10779007 | 0.76 | MAOA (0.33) | TRPV4MAOAMAOBCYP2A6VCAM1 | |
| SCHEMBL29212799 | 0.72 | CYP11B1 (0.38) | CYP11B2CYP11B1MAOAMAOBAR | |
| SCHEMBL16122649 | 0.72 | KHK (0.41) | KHKCYP11B2CYP11B1TRPV4MAOA | |
| SCHEMBL5842957 | 0.70 | TRPV4 (0.42) | KHKCYP11B2CYP11B1TRPV4ESR1 | |
| SCHEMBL978880 | 0.69 | — | — | |
| SCHEMBL975699 | 0.69 | — | — | |
| SCHEMBL5517176 | 0.68 | TRPV4 (0.31) | TRPV4 | |
| SCHEMBL29998893 | 0.68 | CYP2A6 (0.46) | KHKCYP11B2CYP11B1TRPV4MAOA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6093818-A | Substituted pyridazin-3-one compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-07-25 | — | — | US | disclosed |
| EP-0943610-A1 | Substituted Pyridazin-3-one compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-09-22 | — | — | EP | disclosed |