Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
| ▸ | SPR | P35270 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GUSB | P08236 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | F7 | P08709 | 1/20 | 0.37 |
| ▸ | F3 | P13726 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10078141 | 0.78 | GPR84 (0.58) | GPR84ALDH1A1HTR2ASOS1SLC6A4 | |
| SCHEMBL7316265 | 0.77 | GPR84 (0.51) | GPR84ALDH1A1HTR2AMEN1KMT2A | |
| SCHEMBL3180130 | 0.75 | GPR84 (0.53) | GPR84SPRALDH1A1HTR2ANR4A2 | |
| SCHEMBL27550865 | 0.75 | NR4A2 (0.46) | GPR84SPRALDH1A1HTR2ANR4A2 | |
| SCHEMBL11384771 | 0.74 | SPR (0.50) | GPR84SPRALDH1A1HTR2ANR4A2 | |
| SCHEMBL7890292 | 0.73 | NR4A2 (0.47) | GPR84SPRALDH1A1HTR2ANR4A2 | |
| SCHEMBL639590 | 0.71 | CYP2A6 (0.64) | GPR84ALDH1A1NR4A2IDO1DAO | |
| SCHEMBL29958078 | 0.71 | CYP2A6 (0.64) | GPR84ALDH1A1NR4A2IDO1DAO | |
| SCHEMBL24813005 | 0.71 | SPR (0.53) | GPR84SPRALDH1A1HTR2ANR4A2 | |
| SCHEMBL7289250 | 0.71 | SPR (0.47) | GPR84SPRALDH1A1NR4A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012021876-A2 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |