Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.72 |
| ▸ | HTR1D | P28221 | 11/20 | 0.67 |
| ▸ | HTR1B | P28222 | 10/20 | 0.67 |
| ▸ | MPO | P05164 | 3/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29018529 | 0.89 | HTR1A (0.78) | HTR1AHTR1DHTR1BMPOMAPT | |
| SCHEMBL10778563 | 0.86 | HTR1A (0.74) | HTR1AHTR1DHTR1BMPOGABRA1 | |
| SCHEMBL5471393 | 0.84 | HTR1A (0.70) | HTR1AHTR1DHTR1BMPOGABRA1 | |
| SCHEMBL14692901 | 0.83 | HTR1D (0.72) | HTR1AHTR1DHTR1BMPOGABRA1 | |
| SCHEMBL8920992 | 0.81 | HTR1A (0.97) | HTR1AHTR1DHTR1BMPOMAPT | |
| SCHEMBL13964396 | 0.81 | HTR1A (0.66) | HTR1AHTR1DHTR1BMPOHTR2A | |
| SCHEMBL14975308 | 0.80 | HTR1A (1.00) | HTR1AHTR1DHTR1BMPOMAPT | |
| Pyrrole SCHEMBL28770264 | 0.80 | HTR1A (0.85) | HTR1AHTR1DHTR1BMPOMAPT | |
| SCHEMBL5461625 | 0.79 | HTR1A (0.71) | HTR1AHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL31543642 | 0.78 | MTNR1A (0.67) | HTR1AHTR1DHTR1BMPOMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0061333-A1 | 9-(2-(3-Indolyl)ethyl)-1-oxa-4,9-diazaspiro(5.5)undecan-3-ones | SYNTEX (U.S.A.) INC. (US) | 1982-09-29 | — | — | EP | disclosed |
| US-4332804-A | TREATMENT OF HYPERTENSION, CONGESTIVE HEART FAILURE, ARRHYTHMIA, MIGRAINE, VASOSPASTIC DISORDERS AND ASTHMA | SYNTEX (U.S.A.) INC. (US) | 1982-06-01 | — | — | US | disclosed |