Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | HTR1B | P28222 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | MLNR | O43193 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL1282135 | 0.95 | KCNA3 (0.50) | KCNA3LTA4HHTR1BHTR1ADRD2 | |
| SCHEMBL1281987 | 0.79 | KMT2A (0.49) | DRD2KCNH2HRH3LMNAMAPK1 | |
| SCHEMBL31090403 | 0.70 | CHRNA7 (0.47) | KCNA3LTA4HHTR1BHTR1AADRA1A | |
| SCHEMBL28375999 | 0.70 | LSS (0.51) | LTA4HHRH1KCNH2HRH3CHRNB2 | |
| SCHEMBL2126992 | 0.69 | TAAR1 (0.40) | SLC6A2SLC6A4SLC6A3KCNH2HTT | |
| SCHEMBL36192 | 0.68 | LTA4H (0.87) | KCNA3LTA4HHTR1BHTR1ADRD2 | |
| SCHEMBL1331014 | 0.68 | LTA4H (0.87) | KCNA3LTA4HHTR1BHTR1ADRD2 | |
| Benzene SCHEMBL28132981 | 0.68 | LTA4H (0.87) | KCNA3LTA4HHTR1BHTR1ADRD2 | |
| SCHEMBL17309118 | 0.68 | KCNA3 (0.47) | KCNA3LTA4HHTR1BHTR1AMAOA | |
| SCHEMBL10999440 | 0.68 | ALDH1A1 (0.46) | HTR1AADRA1AALDH1A1LMNAMAPK1 |
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-0254797-B1 | 2-HYDROXYETHYL-AZOLE DERIVATIVES | BAYER AG (DE) | 1990-07-04 | — | — | EP | disclosed |
| US-4921529-A | 2-Hydroxyethyl-azole derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1990-05-01 | — | — | US | disclosed |
| EP-0254797-A1 | 2-Hydroxyethyl-azole derivatives | BAYER AG (DE) | 1988-02-03 | — | — | EP | disclosed |