Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HMGCR | P04035 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | SLC13A5 | Q86YT5 | 10/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SLC13A2 | Q13183 | 1/20 | 0.31 |
| ▸ | SLC13A3 | Q8WWT9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829360 | 0.83 | ALDH1A1 (0.60) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL27783525 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL6040141 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL27590670 | 0.77 | ALDH1A1 (0.62) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL9249667 | 0.77 | ALDH1A1 (0.48) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| Citric Acid SCHEMBL424424 | 0.77 | ALDH1A1 (0.68) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| Citric Acid SCHEMBL536596 | 0.77 | ALDH1A1 (0.68) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| SCHEMBL18967973 | 0.77 | PIK3CD (0.36) | HMGCRCHRM1TBXA2RADRA1A | |
| Citric Acid SCHEMBL429569 | 0.77 | ALDH1A1 (0.68) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A | |
| Citric Acid SCHEMBL31518964 | 0.76 | ALDH1A1 (0.83) | ALDH1A1HMGCRCHRM1TBXA2RADRA1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2937094-B1 | PHARMACEUTICAL COMPOSITION FOR TREATING HEADACHE, AND PREPARATION METHOD THEREOF | TASLY PHARMACEUTICAL GROUP CO (CN) | 2018-02-21 | — | — | EP | disclosed |
| US-9795648-B2 | Pharmaceutical composition for treating headache, and preparation method thereof | TASLY PHARMACEUTICAL GROUP CO., LTD. (CN) | 2017-10-24 | — | — | US | disclosed |
| US-20150352168-A1 | Pharmaceutical Composition for Treating Headache, and Preparation Method Thereof | TASLY PHARMACEUTICAL GROUP CO., LTD. (CN) | 2015-12-10 | — | — | US | disclosed |
| EP-2937094-A1 | PHARMACEUTICAL COMPOSITION FOR TREATING HEADACHE, AND PREPARATION METHOD THEREOF | Tasly Pharmaceutical Group Co., Ltd. (CN) | 2015-10-28 | — | — | EP | disclosed |