Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.38 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.38 |
| ▸ | ITGAL | P20701 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CRHBP | P24387 | 2/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28639040 | 0.98 | HTR2A (0.41) | HTR2AKDM1AITGB2ICAM1ITGAL | |
| SCHEMBL30586815 | 0.98 | HTR2A (0.41) | HTR2AKDM1AITGB2ICAM1ITGAL | |
| SCHEMBL30532238 | 0.91 | HTR2A (0.36) | HTR2AKDM1AITGB2ICAM1ITGAL | |
| Phosphoric Acid SCHEMBL31668858 | 0.86 | HTR2A (0.33) | HTR2AKDM1AMAOBOPRM1OPRL1 | |
| SCHEMBL666915 | 0.80 | HTR2A (0.55) | HTR2AKDM1AMAOBTSHRTDP1 | |
| Hydrochloric Acid SCHEMBL30593071 | 0.78 | HTR2A (0.53) | HTR2AKDM1AMAOBTSHRTDP1 | |
| SCHEMBL31741763 | 0.78 | HTR2A (0.53) | HTR2AKDM1AMAOBTSHRTDP1 | |
| SCHEMBL30586769 | 0.75 | DRD1 (0.38) | — | |
| SCHEMBL29445683 | 0.72 | HTR2A (0.48) | HTR2AKDM1AMAOBTSHRTDP1 | |
| SCHEMBL31084187 | 0.69 | HTR2A (0.46) | HTR2AKDM1AMAOBTSHRTDP1 |
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-116655691-A | Synthesis and application of chiral spiro [ chromane-4, 1' -indan ] phosphite monophosphorus ligand | 南开大学 | 2023-08-29 | — | — | CN | disclosed |