Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11809843 | 0.85 | TAS1R3 (0.40) | TAS1R3TAS1R1ADRB2CYP3A4TSHR | |
| Gluconic Acid SCHEMBL11806325 | 0.82 | MAPT (0.51) | ADRB2CYP3A4TSHRKDM4EMAPT | |
| SCHEMBL11805102 | 0.71 | ADRB2 (0.56) | ADRB2CYP3A4TSHRKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL11810811 | 0.70 | ADRB2 (0.57) | ADRB2CYP3A4TSHRKDM4EMAPT | |
| SCHEMBL28352661 | 0.62 | PDE4A (0.52) | TSHRKDM4ETDP1LMNA | |
| SCHEMBL11809441 | 0.61 | ADRB2 (0.42) | TAS1R3TAS1R1ADRB2CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL11806256 | 0.61 | ADRB2 (0.44) | TAS1R3TAS1R1ADRB2CYP3A4TSHR | |
| SCHEMBL11811868 | 0.61 | TAS1R3 (0.56) | TAS1R3TAS1R1ADRB2CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL11810810 | 0.60 | ADRB2 (0.43) | TAS1R3TAS1R1ADRB2CYP3A4TSHR | |
| SCHEMBL1130734 | 0.60 | PDE4A (0.53) | KDM4ETDP1LMNA |
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-3954871-A | ANTIARRHYTHMIA, VASODILATOR, HYPOTENSIVE | CONTINENTAL PHARMA (BE) | 1976-05-04 | — | — | US | disclosed |