Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL19655459 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPK1MTNR1AMTNR1BMAOA | |
| SCHEMBL19655448 | 0.80 | NPC1 (0.40) | ALDH1A1MAPK1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL776647 | 0.78 | ALDH1A1 (1.00) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL19289035 | 0.76 | ALDH1A1 (0.54) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL5171094 | 0.74 | ALDH1A1 (0.71) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL5143403 | 0.72 | ALDH1A1 (0.75) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL575835 | 0.69 | ALDH1A1 (0.70) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL4653863 | 0.68 | ALDH1A1 (0.68) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL420011 | 0.68 | ALDH1A1 (0.78) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL1931125 | 0.68 | ALDH1A1 (0.78) | ALDH1A1MAPK1MTNR1AMTNR1BCYP1A2 |
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 |