Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.40 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8399010 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP1A2HTTTP53PTGDR2 | |
| SCHEMBL8650350 | 0.90 | ALDH1A1 (0.41) | ALDH1A1CYP1A2HTTTP53PTGDR2 | |
| SCHEMBL8395437 | 0.90 | PTGDR2 (0.41) | ALDH1A1HTTTP53PTGDR2SGMS2 | |
| SCHEMBL8395441 | 0.90 | PTGDR2 (0.41) | ALDH1A1HTTTP53PTGDR2SGMS2 | |
| SCHEMBL8519540 | 0.89 | ALDH1A1 (0.42) | ALDH1A1HTTPTGDR2HIF1A | |
| SCHEMBL7067009 | 0.89 | ALDH1A1 (0.42) | ALDH1A1HTTPTGDR2HIF1A | |
| SCHEMBL7221376 | 0.88 | HIF1A (0.50) | ALDH1A1CYP1A2HTTTP53SGMS2 | |
| SCHEMBL8368495 | 0.88 | HIF1A (0.50) | ALDH1A1CYP1A2HTTTP53SGMS2 | |
| SCHEMBL8622758 | 0.88 | TP53 (0.46) | ALDH1A1CYP1A2HTTTP53PTGDR2 | |
| SCHEMBL8622760 | 0.88 | TP53 (0.46) | ALDH1A1CYP1A2HTTTP53PTGDR2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0644183-B1 | Process of producing N-alkylacetamides | SHIONOGI & CO (JP) | 1999-06-02 | — | — | EP | disclosed |
| EP-0658541-B1 | PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE | SHIONOGI & CO (JP) | 1998-05-20 | — | — | EP | disclosed |
| US-5510506-A | Process for producing carboxylic acid derivatives | SHIONOGI & CO., LTD. (JP) | 1996-04-23 | — | — | US | disclosed |
| US-5498792-A | Process of producing N-alkylacetamides | SHIONOGI & CO., LTD. (JP) | 1996-03-12 | — | — | US | disclosed |
| EP-0658541-A1 | PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1995-06-21 | — | — | EP | disclosed |
| EP-0644183-A2 | Process of producing N-alkylacetamides | SHIONOGI & CO., LTD. (JP) | 1995-03-22 | — | — | EP | disclosed |