Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | POLL | Q9UGP5 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8527998 | 0.85 | ADRA1A (0.47) | ADRA1AACHECYP1A2POLLKDM4E | |
| SCHEMBL8528876 | 0.83 | ADRA1A (0.46) | ADRA1AACHECYP1A2POLLKDM4E | |
| SCHEMBL27354246 | 0.83 | ADRA1A (0.46) | ADRA1AACHECYP1A2POLLKDM4E | |
| SCHEMBL8528640 | 0.82 | TDP1 (0.51) | ADRA1AALDH1A1TSHRADRA2CDRD1 | |
| SCHEMBL8531946 | 0.80 | ADRA1A (0.42) | ADRA1AALDH1A1 | |
| SCHEMBL8527972 | 0.78 | ADRA1A (0.41) | ADRA1AACHECYP1A2 | |
| SCHEMBL8903286 | 0.73 | ADRA1A (0.46) | ADRA1AACHECYP1A2POLLKDM4E | |
| SCHEMBL8902168 | 0.73 | ADRA1A (0.37) | ADRA1A | |
| SCHEMBL8530552 | 0.71 | ADRA1A (0.47) | ADRA1AACHEKDM4EALDH1A1DRD2 | |
| SCHEMBL8531237 | 0.70 | ADRA1A (0.46) | ADRA1AACHECYP1A2KDM4EALDH1A1 |
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 |