Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19655459 | 0.82 | ALDH1A1 (0.43) | ALDH1A1PLA2G1BNPSR1ATG4BMAPK1 | |
| SCHEMBL19655457 | 0.78 | — | — | |
| SCHEMBL19655447 | 0.75 | — | — | |
| SCHEMBL19655451 | 0.69 | ALDH1A1 (0.60) | ALDH1A1PLA2G1BNPSR1ATG4BMAPK1 | |
| SCHEMBL12110681 | 0.67 | ALDH1A1 (0.60) | ALDH1A1MAPK1MAOAMAOB | |
| SCHEMBL777671 | 0.66 | ALDH1A1 (0.67) | ALDH1A1MAPK1MAOAMAOB | |
| SCHEMBL19655456 | 0.66 | DHFR (0.36) | ALDH1A1POLBMAOAMAOB | |
| SCHEMBL12110783 | 0.64 | ALDH1A1 (0.63) | ALDH1A1MAPK1MAOAMAOB | |
| SCHEMBL95992 | 0.62 | — | — | |
| SCHEMBL7529643 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9991518-B2 | Polythiophene derivative, method for producing same, positive electrode active material for secondary batteries, and secondary battery | RICOH COMPANY, LTD. (JP) | 2018-06-05 | — | — | US | disclosed |
| US-20170346095-A1 | POLYTHIOPHENE DERIVATIVE, METHOD FOR PRODUCING SAME, POSITIVE ELECTRODE ACTIVE MATERIAL FOR SECONDARY BATTERIES, AND SECONDARY BATTERY | RICOH COMPANY, LTD. (JP) | 2017-11-30 | — | — | US | disclosed |