Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 9/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7317641 | 0.88 | ADRB2 (0.67) | ADRB2ADRB1KDM4ELMNAHTR1A | |
| SCHEMBL7311964 | 0.86 | MAPT (0.57) | ALOX15ADRB2ADRB1KMT2ALMNA | |
| SCHEMBL7309300 | 0.84 | KDM4E (0.48) | ALDH1A1ADRB2ADRB1KDM4EKMT2A | |
| SCHEMBL7312155 | 0.84 | KMT2A (0.61) | ADRB2ADRB1KDM4EKMT2ALMNA | |
| SCHEMBL7309390 | 0.84 | ADRB2 (0.53) | ADRB2ADRB1KDM4ELMNAHTR1A | |
| SCHEMBL7312955 | 0.83 | ADRB2 (0.57) | ALDH1A1ADRB2ADRB1KDM4EKMT2A | |
| SCHEMBL7320621 | 0.83 | KMT2A (0.62) | ADRB2ADRB1KMT2ALMNAHTR1A | |
| SCHEMBL7307680 | 0.82 | ADRB2 (0.55) | ALDH1A1ADRB2ADRB1KDM4EKMT2A | |
| SCHEMBL7317877 | 0.82 | KMT2A (0.61) | ADRB2ADRB1KMT2ALMNAHTR1A | |
| SCHEMBL7308964 | 0.82 | KDM4E (0.56) | ALDH1A1ADRB2ADRB1KDM4EKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4258062-A | ISOPRENALINE ANTAGONISTS EFFECTING HEART RATE AND BLOOD PRESSURE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-03-24 | — | — | US | disclosed |
| US-4171370-A | Phenoxy-amino-propanols | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-10-16 | — | — | US | disclosed |