Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Isobutane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Isobutane SCHEMBL28999947 | 1.00 | — | — | |
| Isobutane SCHEMBL3368265 | 1.00 | — | — | |
| Isobutane SCHEMBL28376961 | 0.91 | — | — | |
| Isobutane SCHEMBL27999649 | 0.91 | ALDH1A1 (0.38) | ALDH1A1TSHRHSD17B10LMNA | |
| Isobutane SCHEMBL27610905 | 0.91 | — | — | |
| Isobutane SCHEMBL30536981 | 0.89 | — | — | |
| Isobutane SCHEMBL7754023 | 0.89 | TSHR (0.50) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Isobutane SCHEMBL20490082 | 0.89 | TSHR (0.50) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Isobutane SCHEMBL11313074 | 0.89 | TSHR (0.50) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Isobutane SCHEMBL768 | 0.89 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114621372-B | Ultra-high molecular weight ethylene homopolymers and process for preparing the same | 中国石油化工股份有限公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-114507310-B | Ultra-high molecular weight ethylene copolymer and preparation method thereof | 中国石油化工股份有限公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-110964132-B | Composite carrier segmented in-situ supported non-metallocene catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2023-08-04 | — | — | CN | disclosed |
| CN-110964136-B | Composite carrier supported non-metallocene catalyst, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-08-04 | — | — | CN | disclosed |
| CN-110964140-B | In-situ supported non-metallocene catalyst, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-08-04 | — | — | CN | disclosed |
| CN-110964137-B | Magnesium compound supported non-metallocene catalyst, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-110964138-B | Magnesium single-carrier segmented in-situ supported non-metallocene catalyst and preparation method thereof | 中国石油化工股份有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-109485762-B | Supported non-metallocene catalyst, preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-26 | — | — | CN | disclosed |
| CN-110964139-B | Magnesium single-carrier in-situ supported non-metallocene catalyst, and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-16 | — | — | CN | disclosed |