Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Isopropyl Alcohol. 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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | TLR2 | O60603 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL8931489 | 0.88 | TSHR (0.42) | TSHRDNM1SPHK1CYP3A4ADRB2 | |
| 1,4-Butanediol SCHEMBL9656423 | 0.84 | SMN1; SMN2 (0.46) | TSHRHTTALDH1A1USP2MEN1 | |
| SCHEMBL39317 | 0.84 | — | — | |
| Propylene Glycol SCHEMBL9656475 | 0.82 | TDP1 (0.42) | TSHRDNM1CYP3A4ALDH1A1USP2 | |
| Di(Hydroxyethyl)Ether SCHEMBL9657555 | 0.81 | TSHR (0.61) | TSHRHTTCYP3A4ALDH1A1USP2 | |
| SCHEMBL3292613 | 0.80 | — | — | |
| Ethylene Glycol SCHEMBL15090416 | 0.79 | MEN1 (0.47) | TSHRDNM1HTTALDH1A1USP2 | |
| Ethylene Glycol SCHEMBL1857077 | 0.79 | MEN1 (0.47) | TSHRDNM1HTTALDH1A1USP2 | |
| Ethylene Glycol SCHEMBL17199804 | 0.79 | MEN1 (0.47) | TSHRDNM1HTTALDH1A1USP2 | |
| Ethylene Glycol SCHEMBL9659047 | 0.78 | USP2 (0.42) | TSHRHTTALDH1A1USP2MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863975-A1 | LIQUID HARD SURFACE DETERGENT COMPOSITIONS CONTAINING SPECIFIC CONCENTRATION OF TARTARIC ACID DETERGENT BUILDER | THE PROCTER & GAMBLE COMPANY (US) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019158-A1 | LIQUID HARD SURFACE DETERGENT COMPOSITIONS CONTAINING SPECIFIC CONCENTRATION OF TARTARIC ACID DETERGENT BUILDER | THE PROCTER & GAMBLE COMPANY (US) | 1997-05-29 | — | — | WO | disclosed |