Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Propanol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Propanol SCHEMBL27889247 | 0.93 | ALDH1A1 (0.45) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Propanol SCHEMBL28970874 | 0.93 | ALDH1A1 (0.45) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Propanol SCHEMBL27705008 | 0.93 | ALDH1A1 (0.45) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Propanol SCHEMBL23711832 | 0.87 | — | — | |
| Propanol SCHEMBL5573890 | 0.87 | — | — | |
| Propanol SCHEMBL8681417 | 0.87 | ALDH1A1 (0.45) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Alcohol SCHEMBL19469387 | 0.86 | TSHR (0.50) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Butyl Alcohol SCHEMBL28781692 | 0.85 | ALDH1A1 (0.61) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Propanol SCHEMBL1484579 | 0.84 | — | — | |
| Propanol SCHEMBL7212358 | 0.84 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103426562-B | Superfine CaSiO3Micro-composite preparation method of conductive powder | PETROCHINA COMPANY LIMITED (CN) | 2016-04-06 | — | — | CN | claimed |
| CN-115043420-B | Porous hollow calcium carbonate nanosphere and preparation method and application thereof | 西安交通大学 | 2023-01-31 | — | — | CN | disclosed |
| CN-115043420-A | Porous hollow calcium carbonate nanosphere and preparation method and application thereof | 西安交通大学 | 2022-09-13 | — | — | CN | disclosed |