Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 12/20 | 0.86 |
| ▸ | HTR1B | P28222 | 11/20 | 0.86 |
| ▸ | HTR1D | P28221 | 10/20 | 0.86 |
| ▸ | HTR2A | P28223 | 5/20 | 0.86 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.86 |
| ▸ | MAPT | P10636 | 2/20 | 0.86 |
| ▸ | HTR2C | P28335 | 2/20 | 0.86 |
| ▸ | HTR7 | P34969 | 2/20 | 0.86 |
| ▸ | HTR6 | P50406 | 2/20 | 0.86 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.86 |
| ▸ | TSHR | P16473 | 1/20 | 0.86 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.86 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.86 |
| ▸ | BLM | P54132 | 1/20 | 0.84 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.84 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.84 |
| ▸ | HTR2B | P41595 | 2/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.64 |
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 | |
|---|---|---|---|---|
| 5-Methoxytryptamine SCHEMBL41982 | 0.93 | HTR1A (1.00) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL29390103 | 0.93 | HTR1A (1.00) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL26617456 | 0.92 | HTR1A (0.97) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL1322980 | 0.92 | NPSR1 (1.00) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL31109114 | 0.92 | NPSR1 (1.00) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL130877 | 0.92 | HTR1A (0.97) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL28681558 | 0.89 | HTR1A (0.91) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL28309973 | 0.89 | HTR1A (0.91) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| 5-Methoxytryptamine SCHEMBL27863884 | 0.88 | HTR1A (0.89) | HTR1AHTR1BHTR1DHTR2ACYP1A2 | |
| SCHEMBL25082440 | 0.86 | HTR2A (0.68) | HTR1AHTR1BHTR1DHTR2ACYP1A2 |
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-102391169-B | The preparation method of N-(5-methoxyl group-3-indolylethyl)-4-substituted phenylpiperazine-1-ethanamide | SHANGHAI CHEMICAL REAGENT INST. (CN) | 2015-10-28 | — | — | CN | disclosed |
| CN-102391169-A | Method for preparing N-(5-methoxy-1H-indole-3-ethyl)-4-subtituted phenylpiperazine-1-acetamide | SHANGHAI CHEMICAL REAGENT RES INST | 2012-03-28 | — | — | CN | disclosed |