Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Propane. 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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.33 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL18188066 | 0.94 | TP53 (0.39) | TP53TDP1KDM4EALDH1A1PSIP1 | |
| Propane SCHEMBL1423596 | 0.94 | TP53 (0.43) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Propane SCHEMBL372201 | 0.94 | TP53 (0.43) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Propane SCHEMBL27693170 | 0.92 | TP53 (0.41) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Propane SCHEMBL5024454 | 0.92 | TP53 (0.41) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Propane SCHEMBL27484901 | 0.92 | TP53 (0.41) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Propane SCHEMBL28226117 | 0.92 | TP53 (0.41) | TP53TDP1ALDH1A1PSIP1PCSK9 | |
| Ethane SCHEMBL18759198 | 0.88 | TDP1 (0.35) | TP53TDP1KDM4EALDH1A1LMNA | |
| Butane SCHEMBL7978404 | 0.86 | TP53 (0.38) | TP53TDP1KDM4EALDH1A1PSIP1 | |
| Butane SCHEMBL2218261 | 0.86 | TP53 (0.41) | TP53TDP1KDM4EALDH1A1PSIP1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10421767-B2 | Aminosilane-functionalized dienes for use in functionalization of elastomeric polymers | TRINSEO EUROPE GMBH (CH) | 2019-09-24 | — | — | US | disclosed |
| US-20180291041-A1 | Aminosilane-Functionalized Dienes for Use in Functionalization of Elastomeric Polymers | TRINSEO EUROPE GMBH (CH) | 2018-10-11 | — | — | US | disclosed |
| EP-3159346-B1 | AMINOSILANE-FUNCTIONALIZED DIENES FOR USE IN FUNCTIONALIZATION OF ELASTOMERIC POLYMERS | TRINSEO EUROPE GMBH (CH) | 2018-07-04 | — | — | EP | disclosed |
| WO-2017067877-A1 | AMINOSILANE-FUNCTIONALIZED DIENES FOR USE IN FUNCTIONALIZATION OF ELASTOMERIC POLYMERS | TRINSEO EUROPE GMBH (CH) | 2017-04-27 | — | — | WO | disclosed |
| EP-3159346-A1 | AMINOSILANE-FUNCTIONALIZED DIENES FOR USE IN FUNCTIONALIZATION OF ELASTOMERIC POLYMERS | Trinseo Europe GmbH (CH) | 2017-04-26 | — | — | EP | disclosed |
| US-8575381-B2 | Trihydridosilyl-terminated polysilanes and methods of preparation | GELEST TECHNOLOGIES, INC. (US) | 2013-11-05 | — | — | US | disclosed |
| US-20120071678-A1 | TRIHYDRIDOSILYL-TERMINATED POLYSILANES AND METHODS OF PREPARATION | GELEST TECHNOLOGIES, INC. (US) | 2012-03-22 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20120071678-A1 | TRIHYDRIDOSILYL-TERMINATED POLYSILANES AND METHODS OF PREPARATION | SI, STT3A, STT3B | ACHE 4605/4885TP53 2742/4885TDP1 2295/4885 |
| US-10421767-B2 | Aminosilane-functionalized dienes for use in functionalization of elastomeric polymers | PRMT3, CCNL2, SRRM2 | ACHE 3531/4885TP53 4200/4885TDP1 3841/4885 |
| US-20180291041-A1 | Aminosilane-Functionalized Dienes for Use in Functionalization of Elastomeric Polymers | PRMT3, CCNL2, SRRM2 | ACHE 3531/4885TP53 4200/4885TDP1 3841/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.