Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 2/20 | 0.43 |
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | NPFFR2 | Q9Y5X5 | 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 | |
|---|---|---|---|---|
| SCHEMBL27250293 | 0.90 | KIF11 (0.51) | KIF11HTR2AHTR2CCES2CA5A | |
| SCHEMBL17407194 | 0.83 | KIF11 (0.50) | KIF11HTR2AHTR2CCES2CES1 | |
| SCHEMBL29738542 | 0.82 | CES2 (0.45) | KIF11CES2CES1CA5ARXRA | |
| SCHEMBL627998 | 0.82 | CES2 (0.45) | KIF11CES2CES1CA5ARXRA | |
| SCHEMBL20703148 | 0.81 | KIF11 (0.49) | KIF11HTR2AHTR2CCA5AMAOB | |
| SCHEMBL20702976 | 0.81 | KIF11 (0.49) | KIF11HTR2AHTR2CCA5AMAOB | |
| SCHEMBL28648773 | 0.81 | KIF11 (0.45) | KIF11HTR2AHTR2CCA5AMAOB | |
| SCHEMBL20702553 | 0.81 | KIF11 (0.49) | KIF11HTR2AHTR2CCA5AMAOB | |
| SCHEMBL28649265 | 0.81 | NOTUM (0.45) | KIF11HTR2AHTR2CCA5AMAOB | |
| SCHEMBL823677 | 0.81 | CES2 (0.64) | KIF11CES2CES1CA5AMAOB |
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-113651710-A | Preparation method of 3, 5-substituted-4-amino trifluoro acetophenone and its derivative | 杭州臻挚生物科技有限公司 | 2021-11-16 | — | — | CN | disclosed |