Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL7416358 | 0.73 | NOTUM (0.41) | HSD17B10NOTUMKDM4EALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL7416277 | 0.72 | NOTUM (0.40) | HSD17B10NOTUMKDM4EALDH1A1MAPT | |
| SCHEMBL12278203 | 0.68 | HSD17B10 (0.52) | HSD17B10CASP1CASP7KDM4EMEN1 | |
| SCHEMBL13497870 | 0.67 | ALDH1A1 (0.48) | HSD17B10NOTUMKDM4EALDH1A1GAA | |
| SCHEMBL7468196 | 0.66 | AR (0.43) | KDM4EMEN1ALDH1A1GAAMAPT | |
| SCHEMBL7420610 | 0.65 | GRIA1 (0.39) | HSD17B10CASP1CASP7NOTUMKDM4E | |
| SCHEMBL7416689 | 0.64 | HSD17B10 (0.34) | HSD17B10CASP1CASP7KDM4EMEN1 | |
| SCHEMBL12718887 | 0.64 | NOTUM (0.48) | NOTUMDRD1DRD2DRD4 | |
| SCHEMBL9919049 | 0.64 | GAA (0.38) | NOTUMGAADRD1 | |
| SCHEMBL9199699 | 0.63 | NOTUM (0.51) | NOTUMKDM4EALDH1A1MAPT |
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-0656003-A1 | CONDENSED INDOLE DERIVATIVES AS 5HT2C AND 5HT2B ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-06-07 | — | — | EP | disclosed |
| WO-1994004533-A1 | CONDENSED INDOLE DERIVATIVES AS 5HT2C AND 5HT2B ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-03-03 | — | — | WO | disclosed |