Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Butanol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.59 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CPA1 | P15085 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL27927590 | 0.85 | — | — | |
| Nitric Acid SCHEMBL1840454 | 0.85 | CA5A (0.50) | TSHRCA5ACA5BALDH1A1TDP1 | |
| Nitric Acid SCHEMBL8379441 | 0.85 | CA5A (0.50) | TSHRCA5ACA5BALDH1A1TDP1 | |
| Propylene Glycol SCHEMBL962369 | 0.82 | — | — | |
| Propylene Glycol SCHEMBL259009 | 0.82 | TDP1 (0.59) | TSHRCA5ACA5BALDH1A1TDP1 | |
| Propylene Glycol SCHEMBL7262024 | 0.82 | TDP1 (0.59) | TSHRCA5ACA5BALDH1A1TDP1 | |
| Propylene Glycol SCHEMBL44181 | 0.82 | TDP1 (0.59) | TSHRCA5ACA5BALDH1A1TDP1 | |
| Nitric Acid SCHEMBL7579556 | 0.81 | CA5A (0.40) | TSHRCA5ACA5BALDH1A1 | |
| Isopropyl Alcohol SCHEMBL10586828 | 0.81 | CA5A (0.61) | TSHRCA5ACA5BALDH1A1LMNA | |
| Nitric Acid SCHEMBL3772020 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0735990-A4 | COMPOSITE GUN PROPELLANT PROCESSING TECHNIQUE | THIOKOL CORP (US) | 1997-05-28 | — | — | EP | claimed |
| EP-0735990-A1 | COMPOSITE GUN PROPELLANT PROCESSING TECHNIQUE | THIOKOL CORPORATION (US) | 1996-10-09 | — | — | EP | claimed |
| WO-1995017358-A1 | COMPOSITE GUN PROPELLANT PROCESSING TECHNIQUE | THIOKOL CORPORATION (US) | 1995-06-29 | — | — | WO | claimed |
| EP-0946464-A4 | AMMONIUM NITRATE PROPELLANTS WITH MOLECULAR SIEVE | UNIVERSAL PROPULSION CO (US) | 2000-12-06 | — | — | EP | disclosed |
| EP-0946464-A1 | AMMONIUM NITRATE PROPELLANTS WITH MOLECULAR SIEVE | Universal Propulsion Company, Inc. (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998056736-A1 | GAS GENERATING COMPOSITION, DEVICE AND METHOD OF USE | ATLANTIC RESEARCH CORPORATION (US) | 1998-12-17 | — | — | WO | disclosed |
| WO-1998023558-A1 | AMMONIUM NITRATE PROPELLANTS WITH MOLECULAR SIEVE | UNIVERSAL PROPULSION CO., INC. (US) | 1998-06-04 | — | — | WO | disclosed |