Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19655451 | 0.84 | ALDH1A1 (0.60) | ALDH1A1MAPK1MAOAMAOBPOLB | |
| SCHEMBL19655461 | 0.82 | ALDH1A1 (0.34) | ALDH1A1MAPK1MAOAMAOBPOLB | |
| SCHEMBL19655456 | 0.81 | DHFR (0.36) | ALDH1A1MAOAMAOBPOLBL3MBTL1 | |
| SCHEMBL777671 | 0.78 | ALDH1A1 (0.67) | ALDH1A1MAPK1MAOAMAOBFFAR1 | |
| SCHEMBL12110783 | 0.75 | ALDH1A1 (0.63) | ALDH1A1MAPK1MAOAMAOBFFAR1 | |
| SCHEMBL11661294 | 0.69 | ALDH1A1 (0.55) | ALDH1A1MAPK1MAOAMAOBPOLB | |
| SCHEMBL12110681 | 0.68 | ALDH1A1 (0.60) | ALDH1A1MAPK1MAOAMAOBFFAR1 | |
| SCHEMBL19655448 | 0.66 | NPC1 (0.40) | ALDH1A1MAPK1MAPTL3MBTL1HTT | |
| SCHEMBL24089845 | 0.64 | ALDH1A1 (0.55) | ALDH1A1MAPK1MAOAMAOBFFAR1 | |
| SCHEMBL30255528 | 0.64 | MAOA (0.52) | ALDH1A1MAPK1MAOAMAOBTDP1 |
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 |