Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 5/20 | 0.36 |
| ▸ | CNR2 | P34972 | 5/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | MMP9 | P14780 | 2/20 | 0.32 |
| ▸ | MMP8 | P22894 | 2/20 | 0.32 |
| ▸ | MMP13 | P45452 | 2/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GPX4 | P36969 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL197162 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL29590106 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL29590107 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL196824 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL196478 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL13708991 | 0.92 | PDK2 (0.40) | CNR1CNR2PDK2HTR7MMP2 | |
| SCHEMBL19442933 | 0.91 | CNR1 (0.40) | CNR1CNR2PDK2MMP2MMP9 | |
| SCHEMBL26050718 | 0.91 | CNR1 (0.40) | CNR1CNR2PDK2MMP2MMP9 | |
| SCHEMBL1921816 | 0.86 | PDK2 (0.42) | CNR1PDK2HTR7AKR1A1AKR1B1 | |
| SCHEMBL1920734 | 0.85 | PDK2 (0.43) | CNR2PDK2MMP2MMP9MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| US-20150021524-A1 | ORGANIC SEMICONDUCTOR COMPOSITIONS | SMARTKEM LIMITED (GB) | 2015-01-22 | — | — | US | disclosed |