Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 10/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 10/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 10/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 10/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 10/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 10/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 10/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 10/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 10/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1190071 | 0.92 | ALDH1A1 (0.60) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL1190069 | 0.92 | ALDH1A1 (0.60) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL1189823 | 0.81 | ALDH1A1 (0.61) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL1189825 | 0.81 | ALDH1A1 (0.61) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL8824515 | 0.81 | CYP1A2 (0.58) | CYP1A2CYP2D6CYP1B1ALDH1A1HDAC1 | |
| SCHEMBL8824516 | 0.81 | CYP1A2 (0.58) | CYP1A2CYP2D6CYP1B1ALDH1A1HDAC1 | |
| SCHEMBL9907020 | 0.81 | ALDH1A1 (0.51) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL3202914 | 0.80 | ALDH1A1 (0.58) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL3202919 | 0.80 | ALDH1A1 (0.58) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR | |
| SCHEMBL21952150 | 0.78 | CA12 (0.53) | CYP1A2CYP2D6CYP1B1ALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11692058-B2 | Synthesis of functional polyurethanes and polyesters from biomass-derived monomers | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2023-07-04 | — | — | US | disclosed |