Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | GPR3 | P46089 | 1/20 | 0.50 |
| ▸ | PLAU | P00749 | 5/20 | 0.47 |
| ▸ | F2 | P00734 | 4/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.47 |
| ▸ | PLG | P00747 | 2/20 | 0.47 |
| ▸ | KLK1 | P06870 | 2/20 | 0.47 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.47 |
| ▸ | F9 | P00740 | 2/20 | 0.46 |
| ▸ | F10 | P00742 | 2/20 | 0.46 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | PLAT | P00750 | 1/20 | 0.42 |
| ▸ | F12 | P00748 | 1/20 | 0.42 |
| ▸ | F7 | P08709 | 1/20 | 0.42 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL549174 | 0.91 | PRSS1 (0.47) | PLAUF2PRSS1PLGKLK1 | |
| Hydrochloric Acid SCHEMBL7054989 | 0.89 | PRSS1 (0.45) | PLAUF2PRSS1PLGKLK1 | |
| SCHEMBL25106253 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL25894321 | 0.81 | ALDH1A1 (0.49) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL21732405 | 0.80 | ALDH1A1 (0.45) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL549114 | 0.79 | PRSS1 (0.48) | PLAUF2PRSS1PLGKLK1 | |
| SCHEMBL17117709 | 0.79 | ALDH1A1 (0.44) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL25654653 | 0.78 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL15041003 | 0.78 | GPR3 (0.54) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL15040950 | 0.78 | GPR3 (0.54) | ALDH1A1MAPTHPGDRAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020085740-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME | 주식회사 엘지화학 | 2020-04-30 | — | — | WO | disclosed |
| WO-2020067823-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | 주식회사 엘지화학 | 2020-04-02 | — | — | WO | disclosed |