Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | TSPO | P30536 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17571960 | 0.87 | APLNR (0.53) | HTR2AADRA1AADRA2ACA12CA1 | |
| SCHEMBL3459047 | 0.83 | HTR2A (0.70) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL13692380 | 0.83 | HTR2A (0.70) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL6203717 | 0.81 | HTR2A (0.68) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL30855280 | 0.80 | HTR2A (0.71) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL11609582 | 0.80 | HTR2A (0.71) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL11609576 | 0.80 | HTR2A (0.71) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| SCHEMBL8583842 | 0.79 | HTR2A (0.52) | HTR2AHSD17B10TSPO | |
| SCHEMBL4960829 | 0.79 | HTR2A (0.74) | HTR2AHSD17B10IDO1ADRA1ATAAR1 | |
| Hydrochloric Acid SCHEMBL11611171 | 0.79 | HTR2A (0.69) | HTR2AHSD17B10IDO1ADRA1ATAAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5736523-A | ADMINISTERING TO THE MAMMAL SUFFERING FROM CANCER | BIOCHEM PHARMA INC. (CA) | 1998-04-07 | — | — | US | disclosed |
| US-5606037-A | Processes antineoplastic heteronaphthoquinones | BIOCHEM PHARMA INC. (CA) | 1997-02-25 | — | — | US | disclosed |
| EP-0659190-A1 | ANTINEOPLASTIC HETERONAPHTHOQUINONES | BIOCHEM PHARMA INC (CA) | 1995-06-28 | — | — | EP | disclosed |
| WO-1994011382-A1 | ANTINEOPLASTIC HETERONAPHTHOQUINONES | BIOCHEM PHARMA INC. (CA) | 1994-05-26 | — | — | WO | disclosed |