Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Tert-Butylbenzene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 known ✓ | P08235 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | ESRRG | P62508 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Tert-Butylbenzene SCHEMBL28197587 | 0.95 | KIF11 (0.41) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL27405094 | 0.95 | KIF11 (0.41) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL454718 | 0.85 | MAPK1 (0.44) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL5965959 | 0.83 | MAPT (0.46) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL27294369 | 0.83 | MAPT (0.46) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL27332948 | 0.83 | MAPK1 (0.42) | KIF11MAPK1ALDH1A1MAPTKMT2A | |
| Tert-Butylbenzene SCHEMBL2568053 | 0.82 | MAPK1 (0.55) | MAPK1ALDH1A1MAPTKMT2ATDP1 | |
| Tert-Butylbenzene SCHEMBL22264599 | 0.82 | MAPK1 (0.55) | MAPK1ALDH1A1MAPTKMT2ATDP1 | |
| Tert-Butylbenzene SCHEMBL22264597 | 0.82 | MAPK1 (0.55) | MAPK1ALDH1A1MAPTKMT2ATDP1 | |
| Tert-Butylbenzene SCHEMBL337648 | 0.82 | MAPK1 (0.55) | MAPK1ALDH1A1MAPTKMT2ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113881141-A | High-transparency antistatic polypropylene woven bag material and preparation method thereof | 浙江坤诚塑业有限公司 | 2022-01-04 | — | — | CN | disclosed |