Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | PMM2 | O15305 | 1/20 | 0.31 |
| ▸ | MPI | P34949 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20650287 | 0.88 | GPR3 (0.42) | IDO1GPR3ALOX5PARP14RAB9A | |
| SCHEMBL20650283 | 0.85 | ALOX5 (0.40) | GPR3ALOX5PARP14RAB9AMAPT | |
| SCHEMBL20650775 | 0.85 | MPI (0.35) | GPR3ALOX5PARP14RAB9AMAPT | |
| SCHEMBL20650309 | 0.84 | — | — | |
| SCHEMBL21020583 | 0.82 | HRH1 (0.39) | IDO1GPR3ALOX5THRBCYP2D6 | |
| SCHEMBL20650796 | 0.82 | GPR3 (0.39) | GPR3ALOX5CYP2D6CHRM1HRH1 | |
| SCHEMBL20650788 | 0.82 | GPR3 (0.34) | GPR3ALOX5PARP14RAB9AMAPT | |
| SCHEMBL20650794 | 0.82 | MAPT (0.35) | GPR3ALOX5PARP14RAB9AMAPT | |
| SCHEMBL20650466 | 0.82 | GPR3 (0.34) | GPR3ALOX5CYP2D6CHRM1HRH1 | |
| SCHEMBL20649622 | 0.81 | MEN1 (0.32) | MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3428152-A1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG Chem, Ltd. (KR) | 2019-01-16 | — | — | EP | disclosed |