Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 13/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 12/20 | 0.63 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR1E | P28566 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10358945 | 0.84 | SLC6A4 (0.45) | SLC6A2SLC6A4SLC6A3HTR2AKCNH2 | |
| SCHEMBL3958609 | 0.84 | DRD2 (0.49) | SLC6A2SLC6A4SLC6A3HTR1AHTR1D | |
| SCHEMBL29481376 | 0.80 | CHRM1 (0.60) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| Hydrochloric Acid SCHEMBL2578979 | 0.79 | CHRM1 (0.59) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL6958628 | 0.78 | SLC6A2 (0.66) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL9443938 | 0.77 | CHRM1 (0.60) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL6961972 | 0.75 | CHRM1 (0.68) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL3681745 | 0.73 | SLC6A2 (0.58) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL12608893 | 0.72 | CHRM1 (0.77) | SLC6A2SLC6A4SLC6A3CHRM1KCNH2 | |
| SCHEMBL7940396 | 0.72 | HPGD (0.57) | KDM4EMAPK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105669531-B | The prodrug of non-steroidal anti-inflammatory drugs with fast skin and membranes penetration speed and its new medical usage | 于崇曦 | 2019-05-07 | — | — | CN | disclosed |