Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6214835 | 0.79 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL16150885 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL3333141 | 0.77 | ERN1 (0.50) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL4984877 | 0.76 | TLR2 (0.53) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL7387678 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL30608694 | 0.76 | ERN1 (0.55) | ALDH1A1KDM4EHPGDERN1POLB | |
| SCHEMBL27341820 | 0.75 | ERN1 (0.45) | ALDH1A1HPGDERN1TDP1TSHR | |
| SCHEMBL27354250 | 0.75 | ERN1 (0.45) | ALDH1A1KDM4EHPGDERN1TDP1 | |
| SCHEMBL2845228 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDPPARGPPARD | |
| SCHEMBL13978664 | 0.73 | ERN1 (0.50) | ALDH1A1KDM4EHPGDPPARGPPARD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5593970-A | ANTITUMOR AND ANTCARCINOGENIC AGENTS; TRETMENT OF CANCEROUS BONE MARROW BEFORE REGRAFTING | BIOCHEM PHARMA INC. (CA) | 1997-01-14 | — | — | US | disclosed |
| US-5348946-A | Heteroanthracycline antitumor analogs | BIOCHEM IMMUNOSYSTEMS, INC. (CA) | 1994-09-20 | — | — | US | disclosed |
| EP-0533744-A1 | HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS | BIOCHEM PHARMA INC. (CA) | 1993-03-31 | — | — | EP | disclosed |
| WO-1992015601-A2 | HETEROANTHRACYCLINE ANTITUMOR ANALOGS | BIOCHEM PHARMA, INC. (CA) | 1992-09-17 | — | — | WO | disclosed |
| EP-0502661-A2 | Heteroanthracycline anti-tumor analogues | BIOCHEM PHARMA INC. (CA) | 1992-09-09 | — | — | EP | disclosed |
| WO-1991019725-A2 | HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS | BIOCHEM PHARMA INC. (CA) | 1991-12-26 | — | — | WO | disclosed |