Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.33 |
| ▸ | HTR1B | P28222 | 2/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7835841 | 0.81 | HTR1A (0.58) | HTR1AHTR2COPRK1HTR1DHTR1B | |
| SCHEMBL9545371 | 0.79 | GPR119 (0.40) | HTR1AHTR2CJAK3HTR1DHTR1B | |
| SCHEMBL7831800 | 0.73 | HTR1A (0.57) | HTR1AHTR2CHTR1DHTR1BCYP2C9 | |
| SCHEMBL8784342 | 0.71 | HTR1A (0.53) | HTR1AHTR2CHTR1DHTR1BGABRP | |
| SCHEMBL27343955 | 0.70 | HTR1A (0.53) | HTR1AHTR2COPRK1HTR1DHTR1B | |
| SCHEMBL21384720 | 0.65 | KDM4E (0.47) | HTR1AJAK3OPRK1HTR1DHTR1B | |
| SCHEMBL3713776 | 0.65 | NR1H2 (0.55) | NAMPT | |
| SCHEMBL9087213 | 0.64 | HTR1A (0.42) | HTR1AHTR2CWDR5FLT3SYK | |
| SCHEMBL9086672 | 0.64 | HTR1A (0.59) | HTR1AHTR2CHTR1DHTR1BWDR5 | |
| SCHEMBL14211589 | 0.63 | HSD11B1 (0.52) | HTR1AHTR1DHTR1BGABRPGABRD |
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-1993018029-A1 | IMIDAZOLE, TRIAZOLE AND TETRAZOLE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1993-09-16 | — | — | WO | disclosed |