Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL161711 | 0.80 | NAALAD2 (0.45) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL2410928 | 0.79 | NAALAD2 (0.52) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL2411890 | 0.79 | NAALAD2 (0.52) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL2409641 | 0.79 | NAALAD2 (0.52) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL9429165 | 0.78 | NAALAD2 (0.44) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL4628164 | 0.77 | HMGCR (0.50) | TSHRALDH1A1HMGCRCHRM1TBXA2R | |
| SCHEMBL28173152 | 0.77 | AR (0.39) | TSHRALDH1A1MEN1THRBKMT2A | |
| SCHEMBL3208305 | 0.77 | NAALAD2 (0.42) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL11056460 | 0.74 | TSHR (0.40) | NAALAD2TSHRALDH1A1MEN1CYP1A2 | |
| SCHEMBL27859986 | 0.74 | TSHR (0.40) | NAALAD2TSHRALDH1A1MEN1CYP1A2 |
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-6215016-B1 | HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA | TORAY INDUSTRIES, INC. (JP) | 2001-04-10 | — | — | US | disclosed |
| EP-0841063-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 1998-05-13 | — | — | EP | disclosed |