Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 7/20 | 0.71 |
| ▸ | HTR1B | P28222 | 7/20 | 0.71 |
| ▸ | HTR1A | P08908 | 5/20 | 0.71 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.53 |
| ▸ | HTR2B | P41595 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 7/20 | 0.49 |
| ▸ | HTR2A | P28223 | 6/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8125735 | 0.90 | HTR1D (0.57) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8138558 | 0.89 | HTR1D (0.65) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8143058 | 0.89 | HTR1D (0.90) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8128493 | 0.88 | HTR1D (0.74) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8132302 | 0.85 | HTR1D (0.62) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8156189 | 0.85 | HTR1D (0.62) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL27536418 | 0.83 | SLC2A1 (0.62) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8121210 | 0.83 | HTR1A (1.00) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8131066 | 0.83 | SLC2A1 (0.71) | HTR1DHTR1BHTR1ASLC2A1HTR2B | |
| SCHEMBL8128015 | 0.80 | HTR1D (0.63) | HTR1DHTR1BHTR1ASLC2A1HTR2B |
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-0975593-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998050358-A1 | INDOLE DERIVATIVES HAVING COMBINED 5HT1A, 5HT1B AND 5HT1D RECEPTOR ANTAGONIST ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1998-11-12 | — | — | WO | disclosed |