Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | HTR1D | P28221 | 1/20 | 0.50 |
| ▸ | HTR1B | P28222 | 1/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | TACR2 | P21452 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4531373 | 1.00 | HTR1A (0.50) | HTR1AHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL4510362 | 0.78 | HTR1A (0.53) | HTR1AHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL6629875 | 0.74 | HDAC1 (0.57) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL564963 | 0.73 | HDAC1 (0.56) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL532789 | 0.72 | HTR1A (0.55) | HTR1AHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL5461625 | 0.71 | HTR1A (0.71) | HTR1AHTR1DHTR1BGABRA1GABRB2 | |
| SCHEMBL12100781 | 0.71 | HTR1A (0.57) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL31070057 | 0.71 | HTR1A (0.57) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL1128166 | 0.71 | HTR1A (0.57) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL30304761 | 0.71 | HTR1A (0.57) | HTR1AHTR1DHTR1BESR1ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009103007-A2 | STEROID HORMONE RECEPTOR MODULATOR COMPOUNDS AND METHODS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2009-08-20 | — | — | WO | disclosed |