Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.54 |
| ▸ | IDO1 | P14902 | 2/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.48 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10735 | 0.98 | — | — | |
| Dimethylamine SCHEMBL2646042 | 0.91 | TAAR1 (0.50) | TAAR1IDO1ACHEENPP2MAP2K4 | |
| SCHEMBL14960038 | 0.85 | PRKCI (0.58) | TAAR1IDO1ACHEENPP2MAP2K4 | |
| Malonic Acid SCHEMBL27771971 | 0.84 | NPC1 (0.50) | CTBP2POLBMEN1CYP3A4KMT2A | |
| SCHEMBL8992941 | 0.83 | LTA4H (0.49) | TAAR1IDO1ACHEDAOTSHR | |
| SCHEMBL9512965 | 0.82 | GAA (0.44) | TAAR1IDO1ENPP2MAP2K4DAO | |
| SCHEMBL20398409 | 0.82 | — | — | |
| SCHEMBL8405030 | 0.81 | CTBP2 (0.55) | CTBP2POLBMEN1CYP1A2CYP3A4 | |
| Piperidine SCHEMBL5490575 | 0.81 | POLB (0.50) | TAAR1IDO1MAP2K4DAOCTBP2 | |
| SCHEMBL14409543 | 0.80 | VNN1 (0.55) | PRSS1PRSS2PRSS3POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-113292510-B | Benzisothiazole compound for inhibiting hypoxia inducible factor 2 activity, preparation method and application thereof | 中国药科大学 | 2022-08-26 | — | — | CN | disclosed |
| CN-113292510-A | Benzisothiazole compound for inhibiting hypoxia inducible factor 2 activity, preparation method and application thereof | 中国药科大学 | 2021-08-24 | — | — | CN | disclosed |