Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PABPC1 | P11940 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | GBA1 | P04062 | 1/20 | 0.54 |
| ▸ | CNR1 | P21554 | 1/20 | 0.54 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.54 |
| ▸ | HRH2 | P25021 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 7/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10426211 | 0.98 | PABPC1 (0.57) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| Dembrexine SCHEMBL9247816 | 0.86 | CYP2D6 (0.72) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| Dembrexine SCHEMBL1815355 | 0.86 | CYP2D6 (0.72) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| Dembrexine SCHEMBL9247402 | 0.85 | CYP3A4 (0.72) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| Dembrexine SCHEMBL10426104 | 0.85 | CYP3A4 (0.72) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| SCHEMBL11592566 | 0.84 | CYP2D6 (0.51) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| SCHEMBL11592561 | 0.84 | CYP2D6 (0.51) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| SCHEMBL11592569 | 0.84 | CYP2D6 (0.51) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| SCHEMBL9628474 | 0.82 | CYP2D6 (0.52) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 | |
| SCHEMBL24446594 | 0.81 | CYP2D6 (0.74) | PABPC1CYP2D6CYP1A2HIF1ACYP2C19 |
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-3996279-A | DIURETIC, SALURETIC, SECRETOLYTIC | GEROT-PHARMAZEUTIKA DR. WALTER OTTO K.G. (OE) | 1976-12-07 | — | — | US | disclosed |