Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 2/20 | 0.59 |
| ▸ | DRD2 | P14416 | 2/20 | 0.59 |
| ▸ | HTR7 | P34969 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | VDR | P11473 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.43 |
| ▸ | TUBB | P07437 | 2/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16796600 | 0.89 | CHRM4 (0.46) | CHRM4DRD2HTR7ALDH1A1CYP1A2 | |
| SCHEMBL16813014 | 0.89 | CHRM4 (0.51) | CHRM4DRD2HTR7ALDH1A1SERPINE1 | |
| SCHEMBL16813021 | 0.89 | CHRM4 (0.51) | CHRM4DRD2HTR7ALDH1A1NR1I2 | |
| SCHEMBL16812981 | 0.88 | CHRM4 (0.46) | CHRM4DRD2HTR7ALDH1A1NR1I2 | |
| SCHEMBL16812980 | 0.87 | ALDH1A1 (0.52) | CHRM4DRD2HTR7ALDH1A1HPGD | |
| SCHEMBL16812971 | 0.87 | ALDH1A1 (0.62) | CHRM4DRD2HTR7ALDH1A1CYP1A2 | |
| SCHEMBL16813006 | 0.85 | P2RX4 (0.46) | CHRM4DRD2HTR7ALDH1A1CYP1A2 | |
| SCHEMBL16796604 | 0.84 | P2RX4 (0.41) | CHRM4DRD2HTR7ALDH1A1KMT2A | |
| SCHEMBL16796688 | 0.84 | P2RX4 (0.47) | CHRM4DRD2HTR7ALDH1A1HPGD | |
| SCHEMBL16812977 | 0.83 | GABRA1 (0.51) | ALDH1A1HPGDP2RX4ADORA3 |
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-2015088565-A1 | P2X4 RECEPTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2015-06-18 | — | — | WO | disclosed |