Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL490996 | 0.96 | ALDH1A1 (0.47) | ALDH1A1CYP2C19LMNATSHR | |
| SCHEMBL460512 | 0.76 | — | — | |
| SCHEMBL5931037 | 0.75 | ALDH1A1 (0.44) | ALDH1A1CYP2C19LMNA | |
| SCHEMBL16174843 | 0.73 | TDP1 (0.42) | ALDH1A1CYP2C19LMNATSHRTDP1 | |
| SCHEMBL270139 | 0.73 | — | — | |
| SCHEMBL2441518 | 0.73 | — | — | |
| SCHEMBL10297717 | 0.73 | — | — | |
| SCHEMBL2148806 | 0.73 | — | — | |
| SCHEMBL23159219 | 0.70 | — | — | |
| SCHEMBL369814 | 0.70 | — | — |
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-1135330-A4 | SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE | EXXONMOBIL RES & ENG CO (US) | 2005-11-16 | — | — | EP | disclosed |
| EP-1135330-A1 | SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE | ExxonMobil Research and Engineering Company (US) | 2001-09-26 | — | — | EP | disclosed |
| WO-2000021884-A1 | SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 2000-04-20 | — | — | WO | disclosed |
| US-5976491-A | Synthesis of and composition of ECR-40, large pore aluminophosphate | EXXON RESEARCH AND ENGINEERING CO. (US) | 1999-11-02 | — | — | US | disclosed |