Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 11/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 10/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 10/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7317693 | 0.77 | ADRB2 (0.65) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| Oxalic Acid SCHEMBL7311294 | 0.77 | ADRB1 (0.57) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL7317581 | 0.76 | ADRB2 (0.41) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL30956734 | 0.66 | ADRB1 (0.69) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL20819581 | 0.66 | ADRB1 (0.69) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL20819580 | 0.66 | ADRB1 (0.69) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL30956739 | 0.66 | ADRB1 (0.69) | ADRB1ADRB2CYP2D6NFKB1HIF1A | |
| SCHEMBL28209406 | 0.63 | PABPC1 (0.48) | ADRB1ADRB2CYP2D6ADRB3 | |
| SCHEMBL1974217 | 0.63 | KIF11 (0.47) | ADRB1CYP2D6NFKB1HIF1ABLM | |
| SCHEMBL29633600 | 0.63 | KIF11 (0.47) | ADRB1CYP2D6NFKB1HIF1ABLM |
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-4018818-A | Hydroxyl-substituted 2-chloro-α-(tert-butylaminomethyl)-benzylalcohols | HOKURIKU PHARMACEUTICAL CO., LTD. (JA) | 1977-04-19 | — | — | US | disclosed |