Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.32 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.32 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.32 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20354836 | 0.76 | IDO1 (0.38) | IDO1HTR2CKDM4EALDH1A1NR4A2 | |
| SCHEMBL29957075 | 0.76 | ALDH1A1 (0.48) | KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL20354695 | 0.74 | TRPV4 (0.44) | IDO1KDM4EALDH1A1HPGDNR3C1 | |
| SCHEMBL20355101 | 0.73 | CSNK2A2 (0.33) | HTR2AHTR2CHTR2BARCSNK2A2 | |
| SCHEMBL20354852 | 0.73 | AR (0.47) | HTR2AHTR2CHTR2BARCSNK2A2 | |
| SCHEMBL10726742 | 0.69 | KDM4E (0.40) | HTR2AHTR2CHTR2BCYP19A1CYP11B1 | |
| SCHEMBL23191293 | 0.68 | CYP19A1 (0.51) | IDO1HTR2AHTR2CHTR2BCYP19A1 | |
| SCHEMBL14339474 | 0.67 | KDM4E (0.50) | HTR2AHTR2CHTR2BCYP19A1CYP11B1 | |
| SCHEMBL17659906 | 0.66 | TNF (0.53) | HTR2AHTR2CHTR2BCYP19A1CYP11B1 | |
| SCHEMBL20355043 | 0.66 | GPR17 (0.34) | ARCSNK2A2CSNK2BCSNK2A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018122232-A1 | (AZA)INDOLE-, BENZOTHIOPHENE-, AND BENZOFURAN-3-SULFONAMIDES | UCB PHARMA GMBH (DE) | 2018-07-05 | — | — | WO | disclosed |