Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.44 |
| ▸ | ATP4A | P20648 | 1/20 | 0.42 |
| ▸ | ATP4B | P51164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11198298 | 0.86 | MGAM (0.48) | DRD2DRD4DRD3GAAPARP1 | |
| SCHEMBL12109685 | 0.81 | LMNA (0.49) | DRD2DRD4DRD3GAAPARP1 | |
| SCHEMBL5071826 | 0.81 | PNP (0.52) | GAACYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL9306184 | 0.81 | GAA (0.42) | GAAHTR6ALKBH3CYP1A2CYP3A4 | |
| SCHEMBL9307952 | 0.81 | NPC1 (0.46) | GAAHTR6ALKBH3CYP1A2CYP3A4 | |
| SCHEMBL8263596 | 0.80 | PARP1 (0.54) | DRD2DRD4DRD3GAAPARP1 | |
| SCHEMBL5788740 | 0.80 | PARP1 (0.54) | DRD2DRD4DRD3PARP1ATP4A | |
| SCHEMBL8816937 | 0.79 | CYP1A2 (0.59) | GAAPARP1CYP1A2CYP2D6GRIN2B | |
| SCHEMBL12109694 | 0.79 | CYP1A2 (0.55) | DRD2DRD4DRD3CYP1A2CYP2D6 | |
| SCHEMBL7981913 | 0.79 | DRD2 (0.49) | DRD2DRD4DRD3PARP1HTR6 |
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-2016044636-A2 | METHOD FOR PRODUCING BENZAZOLOQUINOLIUM (BQS) SALTS AND USING THE BIOLOGICAL ACTIVITY OF THE COMPOSITION | SISTEMA UNIVERSITARIO ANA G. MENDEZ, INC. (US) | 2016-03-24 | — | — | WO | disclosed |
| WO-2004078874-A2 | NOVEL DYE COMPLEXES AND USE THEREOF IN IMAGING MEMBERS AND METHODS | POLAROID CORPORATION (US) | 2004-09-16 | — | — | WO | disclosed |