Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.57 |
| ▸ | HTR2C | P28335 | 4/20 | 0.57 |
| ▸ | HTR1D | P28221 | 4/20 | 0.57 |
| ▸ | HTR1A | P08908 | 3/20 | 0.57 |
| ▸ | HTR2B | P41595 | 3/20 | 0.57 |
| ▸ | HTR1B | P28222 | 2/20 | 0.57 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | HTR1E | P28566 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | HTR7 | P34969 | 1/20 | 0.57 |
| ▸ | HTR6 | P50406 | 1/20 | 0.57 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29280796 | 1.00 | HTR2A (0.57) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL18029226 | 0.83 | KMT2A (0.60) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL18029208 | 0.83 | KMT2A (0.60) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL24913225 | 0.77 | HTR2A (0.66) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL27220697 | 0.77 | HTR2A (0.66) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL22892464 | 0.76 | HTR2C (0.80) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL29280800 | 0.76 | HTR2A (0.64) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL24178315 | 0.76 | HTR2A (0.80) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL24913313 | 0.76 | HTR2A (0.64) | HTR2AHTR2CHTR1DHTR1AHTR2B | |
| SCHEMBL29528195 | 0.76 | HTR2A (0.80) | HTR2AHTR2CHTR1DHTR1AHTR2B |
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-117813288-A | Arylamino derivative estrogen receptor modulator and use thereof | 西藏海思科制药有限公司 | 2024-04-02 | — | — | CN | disclosed |