Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.30 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9814840 | 0.80 | ALDH1A1 (0.39) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL9814922 | 0.77 | KMT2A (0.41) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL9814772 | 0.76 | FFAR3 (0.43) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL9814735 | 0.76 | CYP1A2 (0.36) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL4810549 | 0.73 | LMNA (0.47) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL10579432 | 0.70 | NAALAD2 (0.43) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL11305844 | 0.70 | ALDH1A1 (0.56) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL8856972 | 0.70 | ALDH1A1 (0.45) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL18116106 | 0.70 | NAALAD2 (0.43) | NAALAD2ALDH1A1MEN1CYP1A2THRB | |
| SCHEMBL15100349 | 0.69 | NAALAD2 (0.50) | NAALAD2ALDH1A1MEN1CYP1A2THRB |
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-5010103-A | Anticarcinogenic agents | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF N.Y. (US) | 1991-04-23 | — | — | US | disclosed |
| US-4927966-A | ANTITUMOR | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1990-05-22 | — | — | US | disclosed |