Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MT-ND4 | P03905 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8527137 | 0.84 | MIF (0.45) | ADRA1AKDM4EALDH1A1LMNACYP1A2 | |
| SCHEMBL8529815 | 0.82 | ADRA1A (0.46) | ADRA1AKDM4EALDH1A1CYP1A2HPGD | |
| SCHEMBL8527470 | 0.81 | CYP1A2 (0.47) | ADRA1AALDH1A1CYP1A2HPGDACHE | |
| SCHEMBL8527142 | 0.79 | MIF (0.46) | ADRA1AALDH1A1CYP1A2TDP1HPGD | |
| SCHEMBL8533392 | 0.78 | ADRA1A (0.42) | ADRA1AALDH1A1MAPTCYP2C9CYP1A2 | |
| SCHEMBL8531328 | 0.77 | ADRA1A (0.41) | ADRA1AKDM4EALDH1A1CYP1A2HPGD | |
| SCHEMBL8527872 | 0.76 | ADRA1A (0.40) | ADRA1AALDH1A1CYP1A2HPGDACHE | |
| SCHEMBL8901644 | 0.75 | CTDSP1 (0.44) | ADRA1AKDM4EALDH1A1TSHRCYP1A2 | |
| SCHEMBL8527222 | 0.75 | ADRA1A (0.39) | ADRA1AKDM4EALDH1A1LMNACYP2C19 | |
| SCHEMBL8530160 | 0.74 | ADRA1A (0.38) | ADRA1AALDH1A1CYP1A2HPGDACHE |
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 |