Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.49 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7036650 | 1.00 | CRHBP (0.49) | CRHBPCRHR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9346505 | 0.77 | ICMT (0.47) | CRHBPCRHR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8978987 | 0.77 | ALDH1A1 (0.43) | CYP3A4MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL27693295 | 0.77 | CRHBP (0.70) | CRHBPCRHR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7982311 | 0.76 | ALDH1A1 (0.44) | MEN1KMT2ARAB9ANPC1NOX1 | |
| SCHEMBL29137131 | 0.76 | ALDH1A1 (0.48) | CRHBPCRHR2MEN1KMT2ARAB9A | |
| SCHEMBL28313149 | 0.75 | CXCR2 (0.44) | CRHBPCRHR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9281094 | 0.75 | KDM4E (0.38) | CRHBPCRHR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL50189 | 0.75 | L3MBTL1 (0.52) | MEN1KMT2ARAB9ANPC1NOX1 | |
| Iodide SCHEMBL31634395 | 0.75 | L3MBTL1 (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19MEN1 |
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-2021159372-A1 | USE OF JAK INHIBITORS IN PREPARATION OF DRUGS FOR TREATING JAK KINASE-RELATED DISEASES | 珠海联邦制药股份有限公司 | 2021-08-19 | — | — | WO | disclosed |
| WO-2020063855-A1 | QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2020-04-02 | — | — | WO | disclosed |