Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | MDM4 | O15151 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL15105375 | 0.85 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1MAPTESR1 | |
| SCHEMBL732202 | 0.83 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL30772132 | 0.83 | ALDH1A1 (0.50) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL22367879 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2MAPT | |
| Water SCHEMBL9956053 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL6256646 | 0.81 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL14849661 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL5983424 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHRTDP1CA2MAPT | |
| SCHEMBL21189661 | 0.77 | ESR1 (0.41) | ALDH1A1TSHRTDP1CA2ESR1 | |
| SCHEMBL27669481 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1CA2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113544120-B | Novel compound, composition containing same, self-repairing material, surface coating agent, paint, adhesive, battery material, and cured product | 株式会社ADEKA | 2023-05-02 | — | — | CN | disclosed |
| US-20210047457-A1 | COMPOUND, RESIN, COMPOSITION AND PATTERN FORMATION METHOD | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 2021-02-18 | — | — | US | disclosed |
| WO-1994025501-A1 | EPOXY RESINS CONTAINING THIADIAZOLE AND/OR OXADIAZOLE MOIETIES | THE DOW CHEMICAL COMPANY (US) | 1994-11-10 | — | — | WO | disclosed |