Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Isobutanol SCHEMBL27200593 | 0.97 | ALDH1A1 (0.58) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Isobutanol SCHEMBL1128320 | 0.94 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL195732 | 0.91 | — | — | |
| Butyl Alcohol SCHEMBL5571431 | 0.91 | ALDH1A1 (0.73) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Isobutanol SCHEMBL28097158 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Isobutanol SCHEMBL7219927 | 0.90 | ALDH1A1 (0.55) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| 1-Pentanol SCHEMBL7055991 | 0.90 | SMN1; SMN2 (0.60) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL6045192 | 0.88 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL1440709 | 0.88 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 | |
| Butyl Alcohol SCHEMBL633562 | 0.88 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014144726-A2 | METHODS FOR FULLY SEGREGATING RECOMBINANT MARINE CYANOBACTERIA | ALGENOL BIOFUELS INC. (US) | 2014-09-18 | — | — | WO | disclosed |
| US-20090159850-A1 | Solvent Compositions | SOLVAY S.A. (BE) | 2009-06-25 | — | — | US | disclosed |
| US-20020061970-A1 | Resin composition for coating material | KANSAI PAINT CO., LTD. (JP) | 2002-05-23 | — | — | US | disclosed |