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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
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 SCHEMBL9737750 | 1.00 | — | — | |
| Isopropyl Alcohol SCHEMBL538205 | 1.00 | TP53 (0.61) | TP53ALDH1A1LMNACA1CA2 | |
| Isopropyl Alcohol SCHEMBL28292853 | 0.95 | TP53 (0.57) | TP53ALDH1A1LMNACA1CA2 | |
| Isopropyl Alcohol SCHEMBL28288247 | 0.95 | — | — | |
| Isopropyl Alcohol SCHEMBL15251690 | 0.95 | TP53 (0.57) | TP53ALDH1A1LMNACA1CA2 | |
| Bicarbonate SCHEMBL2159674 | 0.90 | — | — | |
| Isopropyl Alcohol SCHEMBL28865623 | 0.88 | TP53 (0.50) | TP53ALDH1A1LMNACA1CA2 | |
| Oxalic Acid SCHEMBL890984 | 0.86 | TP53 (0.57) | TP53ALDH1A1LMNATSHRFFAR3 | |
| Acetic Acid SCHEMBL574619 | 0.86 | FFAR3 (0.64) | TP53ALDH1A1LMNATSHRFFAR3 | |
| Acetic Acid SCHEMBL9659096 | 0.86 | FFAR3 (0.64) | TP53ALDH1A1LMNATSHRFFAR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1871855-B1 | DIHYDROXY ENOL COMPOUNDS USED IN CHEMICAL MECHANICAL POLISHING COMPOSITIONS HAVING METAL ION OXIDIZERS | DUPONT AIR PROD NANOMATERIALS (US) | 2010-03-24 | — | — | EP | claimed |
| EP-0207161-B1 | PROCESS FOR PRODUCING ETHYLENE COPOLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1989-07-12 | — | — | EP | disclosed |
| US-4721761-A | HIGH PRESSURE REACTOR | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-01-26 | — | — | US | disclosed |
| EP-0207161-A1 | PROCESS FOR PRODUCING ETHYLENE COPOLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-01-07 | — | — | EP | disclosed |