Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.43 |
| ▸ | HTR2C | P28335 | 6/20 | 0.43 |
| ▸ | HTR2B | P41595 | 6/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24675075 | 1.00 | HTR2A (0.43) | HTR2AHTR2CHTR2BHCRTR1HCRTR2 | |
| SCHEMBL24675377 | 0.76 | HTR2A (0.42) | HTR2AHTR2CHTR2BHCRTR1HCRTR2 | |
| SCHEMBL24675070 | 0.73 | MEN1 (0.36) | HTR2AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL24675063 | 0.73 | MEN1 (0.36) | HTR2AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL24675059 | 0.73 | MEN1 (0.36) | HTR2AHTR2CHTR2BMEN1KMT2A | |
| SCHEMBL26958160 | 0.70 | HTR2A (0.47) | HTR2AHTR2CHTR2BALDH1A1SMN1; SMN2 | |
| SCHEMBL24640938 | 0.68 | HTR2A (0.38) | HTR2AHTR2CHTR2BCYP2D6CYP2C9 | |
| SCHEMBL24640360 | 0.68 | HTR2A (0.38) | HTR2AHTR2CHTR2BCYP2D6CYP2C9 | |
| SCHEMBL46330 | 0.68 | GRM5 (0.37) | ALDH1A1HTR3A | |
| SCHEMBL24675043 | 0.67 | HTR2A (0.37) | HTR2AHTR2CHTR2BCYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022223022-A1 | FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2022-10-27 | — | — | WO | disclosed |