Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 7/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 6/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | MTOR | P42345 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11804077 | 0.87 | ADRB2 (0.55) | ADRB1ADRB2ADRB3MAPTTSHR | |
| Hydrochloric Acid SCHEMBL11812398 | 0.86 | ADRB2 (0.56) | ADRB1ADRB2ADRB3MAPTTSHR | |
| SCHEMBL11809441 | 0.85 | ADRB2 (0.42) | ADRB1ADRB2ADRB3MAPTTSHR | |
| SCHEMBL11813541 | 0.84 | ADRB2 (0.41) | ADRB1ADRB2ADRB3MAPTTSHR | |
| Hydrochloric Acid SCHEMBL11810810 | 0.84 | ADRB2 (0.43) | ADRB1ADRB2ADRB3MAPTTSHR | |
| SCHEMBL13986542 | 0.81 | CYP3A4 (0.43) | ADRB1ADRB2ADRB3MAPTTSHR | |
| SCHEMBL11809557 | 0.81 | CYP2D6 (0.45) | ADRB1ADRB2ADRB3TSHRMAPK1 | |
| SCHEMBL11185383 | 0.76 | ADRB2 (0.59) | ADRB1ADRB2TSHRCYP3A4KDM4E | |
| SCHEMBL7146847 | 0.75 | BLM (0.47) | ADRB1ADRB2ADRB3MAPTTSHR | |
| SCHEMBL11815180 | 0.75 | SLC6A2 (0.39) | CYP3A4CYP2D6SLC6A2SLC6A4SLC6A3 |
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 |