Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.39 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL574839 | 0.94 | HCAR2 (0.40) | HCAR2HCAR3HTTTYRKDM4E | |
| SCHEMBL8778776 | 0.79 | — | — | |
| SCHEMBL23012479 | 0.78 | MEN1 (0.36) | HCAR2ALDH1A1 | |
| SCHEMBL23013150 | 0.78 | HCAR2 (0.42) | HCAR2 | |
| SCHEMBL10438305 | 0.78 | HRH3 (0.38) | HCAR2HCAR3MAPK1NPC1HPGD | |
| SCHEMBL7016897 | 0.78 | HRH3 (0.38) | HCAR2HCAR3HRH3SMPD3TYR | |
| SCHEMBL11832991 | 0.76 | HRH3 (0.41) | HCAR2HCAR3MAPK1NPC1RAB9A | |
| SCHEMBL27675062 | 0.76 | HRH3 (0.37) | HCAR2HCAR3HRH3SMPD3GABRP | |
| SCHEMBL27854797 | 0.76 | HRH3 (0.37) | HCAR2HCAR3MAPK1NPC1RAB9A | |
| SCHEMBL27148657 | 0.74 | NUDT1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022223336-A1 | POLYMERIZATION INHIBITORS | BASF SE (DE) | 2022-10-27 | — | — | WO | disclosed |
| EP-0043917-B1 | ESTERS OF N-ACYLATED-N-METHYL-0-PYRAZOL(4)YL-CARBAMIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION AS BIOCIDES | BAYER AG (DE) | 1984-10-24 | — | — | EP | disclosed |