Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 12/20 | 0.63 |
| ▸ | ADRB1 | P08588 | 11/20 | 0.63 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.63 |
| ▸ | HTR1A | P08908 | 6/20 | 0.63 |
| ▸ | LMNA | P02545 | 5/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.63 |
| ▸ | HTR2C | P28335 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | DRD3 | P35462 | 3/20 | 0.63 |
| ▸ | TSHR | P16473 | 3/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.63 |
| ▸ | TP53 | P04637 | 2/20 | 0.63 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.63 |
| ▸ | HTR1B | P28222 | 2/20 | 0.63 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.63 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL11242745 | 0.85 | ADRB2 (0.73) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Hydrochloric Acid SCHEMBL11248041 | 0.84 | ADRB2 (0.73) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| SCHEMBL11331685 | 0.84 | ADRB2 (0.75) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Hydrochloric Acid SCHEMBL11462740 | 0.83 | ADRB2 (0.76) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| SCHEMBL11333344 | 0.82 | HTR1A (0.51) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Pindolol SCHEMBL5220 | 0.78 | HTR1A (1.00) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Pindolol SCHEMBL1157882 | 0.78 | HTR1A (1.00) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| SCHEMBL22861857 | 0.78 | ADRB2 (0.66) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Pindolol SCHEMBL5219 | 0.78 | HTR1A (1.00) | ADRB2ADRB1ADRB3CYP1A2HTR1A | |
| Pindolol SCHEMBL29908300 | 0.78 | HTR1A (1.00) | ADRB2ADRB1ADRB3CYP1A2HTR1A |
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-4215134-A | B-RECEPTOR BLOCKING AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1980-07-29 | — | — | US | disclosed |