Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9630707 | 0.81 | ADRA2C (0.40) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL11872427 | 0.79 | SMN1; SMN2 (0.44) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL10348036 | 0.79 | ADRA2C (0.45) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL24353892 | 0.79 | GABRA1 (0.42) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL8118870 | 0.79 | XDH (0.45) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL8985125 | 0.77 | ADRA2C (0.41) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL9463381 | 0.77 | TAAR1 (0.36) | ALDH1A1CYP2C19CYP1A2TSHR | |
| SCHEMBL601036 | 0.77 | GABRA1 (0.45) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL3257629 | 0.74 | ADRA2C (0.47) | ADRA2CADRA2AADRA2BGABRA1GABRB2 | |
| SCHEMBL11874663 | 0.73 | ADRA2C (0.49) | ADRA2CADRA2AADRA2BGABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3864020-A1 | MACROCYCLIC FLU ENDONUCLEASE INHIBITORS | Janssen BioPharma, Inc. (US) | 2021-08-18 | — | — | EP | disclosed |
| CN-113195502-A | Macrocyclic influenza endonuclease inhibitors | 詹森生物制药有限公司 | 2021-07-30 | — | — | CN | disclosed |