Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 4/20 | 0.47 |
| ▸ | TNKS | O95271 | 4/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 4/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8527533 | 0.74 | CYP1A2 (0.39) | ADRA1AMEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL8531328 | 0.73 | ADRA1A (0.41) | ADRA1AALDH1A1ACHEKDM4E | |
| SCHEMBL8527998 | 0.72 | ADRA1A (0.47) | ADRA1AALDH1A1ACHEDRD2KDM4E | |
| SCHEMBL27354246 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEDRD1DRD2 | |
| SCHEMBL8531237 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEDRD1DRD2 | |
| SCHEMBL8529815 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEKDM4EGAA | |
| SCHEMBL8903286 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEKDM4EGAA | |
| SCHEMBL8528876 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEKDM4E | |
| SCHEMBL8528043 | 0.71 | ADRA1A (0.46) | ADRA1AALDH1A1ACHEDRD1DRD2 | |
| SCHEMBL8527222 | 0.71 | ADRA1A (0.39) | ADRA1AMEN1KMT2AALDH1A1ACHE |
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 3 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 |