Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.43 |
| ▸ | PPARG | P37231 | 7/20 | 0.43 |
| ▸ | PPARD | Q03181 | 7/20 | 0.43 |
| ▸ | PPARA | Q07869 | 7/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29233116 | 0.98 | GPR84 (0.47) | TSHRALDH1A1EPHX2GPR84PPARG | |
| SCHEMBL29233131 | 0.98 | GPR84 (0.47) | TSHRALDH1A1EPHX2GPR84PPARG | |
| SCHEMBL29233103 | 0.94 | GAA (0.44) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL159556 | 0.90 | TSHR (0.55) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL25177394 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL25211905 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL17163937 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL25199003 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL22835020 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 | |
| SCHEMBL22835017 | 0.88 | GPR84 (0.56) | AKR1B1TSHRALDH1A1EPHX2GPR84 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118382612-A | Method for producing blocked isocyanate compound and method for producing isocyanate compound | 旭化成株式会社 | 2024-07-23 | — | — | CN | disclosed |
| CN-118215651-A | Method for producing isocyanate compound, method for producing urethane compound, method for recovering amine compound, and isocyanate composition | 旭化成株式会社 | 2024-06-18 | — | — | CN | disclosed |