Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 3/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 0.32 |
| ▸ | PTPRF | P10586 | 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 | |
|---|---|---|---|---|
| SCHEMBL8531892 | 0.72 | ADRA1A (0.41) | ADRA1AACHEIMPDH2IMPDH1KDM4E | |
| SCHEMBL8530552 | 0.71 | ADRA1A (0.47) | ADRA1AACHEKDM4EALDH1A1DRD2 | |
| SCHEMBL8527998 | 0.71 | ADRA1A (0.47) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL8529815 | 0.70 | ADRA1A (0.46) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL8528876 | 0.70 | ADRA1A (0.46) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL8528043 | 0.70 | ADRA1A (0.46) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL8903286 | 0.70 | ADRA1A (0.46) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL27354246 | 0.70 | ADRA1A (0.46) | ADRA1AACHEKDM4EALDH1A1CYP1A2 | |
| SCHEMBL8528366 | 0.69 | ADRA1A (0.44) | ADRA1AACHEKDM4EUSP2ALDH1A1 | |
| SCHEMBL8527470 | 0.69 | CYP1A2 (0.47) | ADRA1AACHEALDH1A1CYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5606037-A | Processes antineoplastic heteronaphthoquinones | BIOCHEM PHARMA INC. (CA) | 1997-02-25 | — | — | US | claimed |
| 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 |