Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | ELANE | P08246 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4493170 | 0.87 | ESR1 (0.45) | ESR1ESR2PTPN1ALDH1A1KDM4E | |
| SCHEMBL7252826 | 0.77 | ESR1 (0.37) | ESR1ESR2PTPN1ALDH1A1KDM4E | |
| SCHEMBL5229303 | 0.75 | KDM4E (0.40) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| SCHEMBL6708105 | 0.74 | ALDH1A1 (0.43) | ESR1ALDH1A1KDM4EHPGDELANE | |
| SCHEMBL9311258 | 0.69 | GAA (0.40) | ESR1ALDH1A1KDM4EHPGDELANE | |
| SCHEMBL6652020 | 0.67 | ALDH1A1 (0.56) | PTPN1ALDH1A1KDM4EHPGDKMT2A | |
| SCHEMBL11096458 | 0.66 | TDP1 (0.43) | ALDH1A1KDM4EHPGDKMT2APOLB | |
| SCHEMBL4501863 | 0.66 | CDK4 (0.44) | ESR1ALDH1A1KDM4EHPGDELANE | |
| SCHEMBL29857622 | 0.66 | ALDH1A1 (0.49) | ESR1ESR2ALDH1A1KDM4EHPGD | |
| Xanthone SCHEMBL28171995 | 0.66 | MAOA (0.64) | ALDH1A1KDM4EHPGDKMT2APOLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5340818-A | Treating leukemia with acridine-9-one derivative(glyfoline) | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1994-08-23 | — | — | US | disclosed |
| WO-1990014008-A1 | METHODS AND COMPOSITIONS FOR INHIBITING TUMOR CELL GROWTH | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1990-11-29 | — | — | WO | disclosed |