Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21667940 | 0.85 | KDM4E (0.40) | ALDH1A1CYP1A2HRH3LMNACYP2D6 | |
| SCHEMBL11923452 | 0.81 | CYP2D6 (0.44) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL19888347 | 0.80 | SMN1; SMN2 (0.47) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL18909499 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL20332899 | 0.79 | TSHR (0.47) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL21791808 | 0.78 | TSHR (0.43) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL23471084 | 0.78 | CYP2D6 (0.42) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL12422516 | 0.78 | CYP3A4 (0.42) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL16019413 | 0.78 | CYP2D6 (0.42) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 | |
| SCHEMBL3305244 | 0.77 | ALDH1A1 (0.54) | ALDH1A1MAPK1CYP1A2CHRM2CHRM1 |
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-9834560-B2 | Compounds | RESPIVERT LTD. (GB) | 2017-12-05 | — | — | US | disclosed |