Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT2 | O75908 | 1/20 | 0.57 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.55 |
| ▸ | ICMT | O60725 | 1/20 | 0.54 |
| ▸ | ALB | P02768 | 1/20 | 0.54 |
| ▸ | GPR84 | Q9NQS5 | 6/20 | 0.53 |
| ▸ | PPARG | P37231 | 6/20 | 0.53 |
| ▸ | PPARD | Q03181 | 6/20 | 0.53 |
| ▸ | PPARA | Q07869 | 6/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | TLR2 | O60603 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | FABP4 | P15090 | 2/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.53 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Valeric Acid SCHEMBL28488681 | 0.95 | ALDH1A1 (0.58) | SOAT2SOAT1ALDH1A1NPSR1EPHX1 | |
| Hexane SCHEMBL28335623 | 0.91 | ALDH1A1 (0.66) | SOAT2SOAT1ALDH1A1NPSR1EPHX1 | |
| Undecane SCHEMBL28335641 | 0.89 | EPHX1 (0.67) | SOAT2SOAT1ALDH1A1NPSR1EPHX1 | |
| Heptane SCHEMBL28333277 | 0.89 | EPHX1 (0.67) | SOAT2SOAT1ALDH1A1NPSR1EPHX1 | |
| Decane SCHEMBL28485199 | 0.89 | EPHX1 (0.67) | SOAT2SOAT1ALDH1A1NPSR1EPHX1 | |
| Stearic Acid SCHEMBL21838311 | 0.87 | HSD17B10 (0.61) | SOAT2SOAT1ALDH1A1EPHX1HTT | |
| Octanoic Acid SCHEMBL28134058 | 0.86 | EPHX1 (0.60) | SOAT2SOAT1ALDH1A1EPHX1HTT | |
| Diphenylamine SCHEMBL21145171 | 0.86 | AKR1B1 (0.59) | SOAT2SOAT1ALDH1A1AKR1B1GPR84 | |
| Stearic Acid SCHEMBL28123864 | 0.85 | SOAT2 (0.57) | SOAT2SOAT1ALDH1A1EPHX1HTT | |
| Diphenylamine SCHEMBL21145136 | 0.84 | GPR84 (0.61) | SOAT2SOAT1ALDH1A1AKR1B1GPR84 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112020493-B | Method for producing urethane and method for producing isocyanate | 旭化成株式会社 | 2023-04-21 | — | — | CN | disclosed |
| CN-114728892-A | Method for producing isocyanate | 旭化成株式会社 | 2022-07-08 | — | — | CN | disclosed |
| CN-110546135-B | Method for producing isocyanate | 旭化成株式会社 | 2021-12-14 | — | — | CN | disclosed |
| CN-112020493-A | Method for producing carbamate and method for producing isocyanate | 旭化成株式会社 | 2020-12-01 | — | — | CN | disclosed |
| CN-110546135-A | Method for producing isocyanate | ASAHI CHEMICAL IND | 2019-12-06 | — | — | CN | disclosed |