Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 15/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL1145899 | 0.80 | ADRB2 (0.54) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL14255720 | 0.74 | ADRB2 (0.49) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL13181489 | 0.69 | ADRB2 (0.47) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL12866429 | 0.68 | ADRB2 (0.46) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL17635440 | 0.67 | ADRB2 (0.48) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL10215349 | 0.67 | ADRB2 (0.54) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL10450797 | 0.65 | ADRB2 (0.57) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL22607306 | 0.65 | ADRB2 (0.57) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL14220262 | 0.65 | ADRB2 (0.57) | ADRB2CYP1A2CYP2D6TSHRNFKB1 | |
| SCHEMBL14622394 | 0.65 | ADRB2 (0.54) | ADRB2CYP1A2CYP2D6TSHRNFKB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2175863-B1 | SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES | EASTERN VIRGINIA MEDICAL SCHOOL (US) | 2018-03-21 | — | — | EP | disclosed |