Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.36 |
| ▸ | CTRC | Q99895 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14370492 | 0.82 | KDM1A (0.47) | KDM4ESMN1; SMN2MAPTPTGS2SLC6A4 | |
| SCHEMBL10158655 | 0.82 | CTRC (0.34) | ALDH1A1KDM4EHSD17B10MEP1BTAS1R3 | |
| SCHEMBL24986390 | 0.82 | HTT (0.43) | ALDH1A1KDM4ETAS1R3TAS1R1CLCN2 | |
| SCHEMBL14948911 | 0.80 | MEP1B (0.55) | ALDH1A1KDM4EHSD17B10TSHRMEP1B | |
| SCHEMBL29536407 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EHSD17B10TSHRTAS1R3 | |
| SCHEMBL2355429 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EHSD17B10TSHRTAS1R3 | |
| SCHEMBL20018063 | 0.76 | ALDH1A1 (0.71) | ALDH1A1KDM4EHSD17B10TSHRMEP1B | |
| SCHEMBL20415199 | 0.76 | PTGS2 (0.41) | ALDH1A1KDM4EHSD17B10GAAMAPT | |
| SCHEMBL10978584 | 0.75 | GABRA1 (0.41) | ALDH1A1KDM4EHSD17B10SMN1; SMN2L3MBTL1 | |
| SCHEMBL1547630 | 0.75 | CLCN2 (0.45) | TSHRSMN1; SMN2CLCN2CTRCMAPT |
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-3458066-B1 | FUSED PYRAZINE DERIVATIVES USEFUL AS SOLUBLE GUANYLATE CYCLASE STIMULATORS | MERCK SHARP & DOHME LLC (US) | 2023-05-03 | — | — | EP | disclosed |
| CN-103097364-B | Spiro-piperidine derivatives as S1P modulators | ABBOTT HEALTHCARE PRODUCTS B.V. (NL) | 2015-11-25 | — | — | CN | disclosed |