Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | GLA | P06280 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.55 |
| ▸ | DRD4 | P21917 | 2/20 | 0.55 |
| ▸ | DRD3 | P35462 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5483450 | 0.91 | DRD2 (0.60) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL14430804 | 0.84 | DRD2 (0.57) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL279945 | 0.84 | NPSR1 (0.97) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9259369 | 0.83 | CD274 (0.60) | ALDH1A1CYP1A2CYP2D6POLBCA12 | |
| SCHEMBL10195008 | 0.82 | NPSR1 (0.94) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL12132533 | 0.82 | LMNA (0.64) | ALDH1A1HDAC6HDAC2HDAC8MEN1 | |
| SCHEMBL10264587 | 0.81 | NPSR1 (0.72) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL10202448 | 0.81 | MEN1 (0.77) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL14608174 | 0.81 | NPSR1 (0.72) | NPSR1ALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL22015906 | 0.81 | HDAC1 (0.71) | ALDH1A1POLBHDAC6HDAC2HDAC8 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0738138-A1 | QUATERNARY SALTS OF PARA-DIALKYLAMINO BENZAMIDE DERIVATIVES | ISP Van Dyk Inc. (US) | 1996-10-23 | — | — | EP | disclosed |
| EP-0738138-A4 | QUATERNARY SALTS OF PARA-DIALKYLAMINO BENZAMIDE DERIVATIVES | ISP VAN DYK INC (US) | 1996-07-08 | — | — | EP | disclosed |
| US-5451394-A | Quaternary salts of para-dialkylamino benzamide derivatives | ISP VAN DYK INC. (US) | 1995-09-19 | — | — | US | disclosed |
| WO-1995005797-A1 | QUATERNARY SALTS OF PARA-DIALKYLAMINO BENZAMIDE DERIVATIVES | ISP VAN DYK INC. (US) | 1995-03-02 | — | — | WO | disclosed |