Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL28496033 | 0.94 | SIGMAR1 (0.33) | HTR2AHTR6SIGMAR1RETTACR1 | |
| Hydrochloric Acid SCHEMBL3212771 | 0.85 | HTR6 (0.33) | HTR2AHTR6SIGMAR1RETSLC6A2 | |
| SCHEMBL3212779 | 0.82 | SIGMAR1 (0.33) | HTR2AHTR6SIGMAR1RET | |
| SCHEMBL7099883 | 0.80 | HTR2A (0.37) | HTR2AHTR6SIGMAR1RETSLC6A2 | |
| SCHEMBL6273009 | 0.80 | SIGMAR1 (0.36) | HTR2AHTR6SIGMAR1 | |
| SCHEMBL28504217 | 0.79 | HTR2A (0.36) | HTR2AHTR6SIGMAR1RETSLC6A2 | |
| SCHEMBL7099240 | 0.77 | HTR6 (0.53) | HTR2AHTR6SIGMAR1 | |
| SCHEMBL1415858 | 0.76 | L3MBTL1 (0.36) | HTR2AHTR6SIGMAR1KDM4ELMNA | |
| SCHEMBL6275902 | 0.76 | MAPT (0.34) | SIGMAR1TP53HSD17B10 | |
| SCHEMBL3192882 | 0.75 | MAPT (0.38) | SIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111620914-B | Side-arm metallocene tetravalent transition metal complex containing neutral benzyl heteroatom ligand and application thereof | 吉林大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-111620914-A | Side-arm metallocene tetravalent transition metal complex containing neutral benzyl heteroatom ligand and application thereof | 吉林大学 | 2020-09-04 | — | — | CN | disclosed |