Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 7/20 | 0.44 |
| ▸ | HTR1B | P28222 | 3/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 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 | |
|---|---|---|---|---|
| SCHEMBL28293145 | 0.89 | KIF11 (0.37) | HTR1DHTR1BHTR1AKIF11ALDH1A1 | |
| SCHEMBL27691272 | 0.88 | IDO1 (0.40) | HTR1AKIF11HTR2AHTR2CHTR2B | |
| SCHEMBL27439207 | 0.82 | TP53 (0.45) | HTR1DHTR2AHTR2CHTR2BMTNR1A | |
| SCHEMBL27566289 | 0.81 | HTR2C (0.46) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL27650369 | 0.81 | NR4A2 (0.46) | HTR2AHTR2CHTR2BMTNR1AMTNR1B | |
| SCHEMBL27648954 | 0.81 | HTR2A (0.41) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL27447132 | 0.81 | HTR2A (0.46) | HTR2AHTR2CMTNR1AMTNR1B | |
| SCHEMBL27613735 | 0.81 | HTR2A (0.46) | HTR2A | |
| SCHEMBL28672698 | 0.80 | HTR2A (0.59) | HTR1DHTR1BHTR1AHTR2AHTR2C | |
| SCHEMBL18806106 | 0.79 | HTR1D (0.53) | HTR1DHTR1BHTR1AKIF11HTR2A |
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-109748840-A | A kind of synthetic method of 2- substituted indole derivative | 中国医学科学院药物研究所 | 2019-05-14 | — | — | CN | disclosed |