Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Acetic Acid Pentyl Ester SCHEMBL7772491 | 0.98 | ALDH1A1 (0.63) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL11076273 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL1527432 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL8056744 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL9336718 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL9418066 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL451540 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Acetic Acid Butyl Ester SCHEMBL3182016 | 0.92 | ALDH1A1 (0.72) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Octyl Acetate SCHEMBL6670138 | 0.91 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 | |
| Dodecylacetate SCHEMBL6669125 | 0.91 | TSHR (0.58) | ALDH1A1TSHRLMNATP53CYP3A4 |
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-0745108-B1 | ELASTICITY IMPARTING AGENTS FOR PAINTS, A METHOD OF MANUFACTURE AND PAINTS | BASF COATINGS AG (DE) | 2000-09-06 | — | — | EP | disclosed |
| US-5908900-A | ACRYLATED POLYURETHANE | BASF COATINGS AG (DE) | 1999-06-01 | — | — | US | disclosed |
| EP-0745108-A1 | ELASTICITY IMPARTING AGENTS FOR PAINTS, A METHOD OF MANUFACTURE AND PAINTS | BASF Lacke + Farben AG (DE) | 1996-12-04 | — | — | EP | disclosed |
| WO-1995021895-A2 | ELASTICITY IMPARTING AGENTS FOR PAINTS, A METHOD OF MANUFACTURE AND PAINTS | BASF LACKE + FARBEN AG (DE) | 1995-08-17 | — | — | WO | disclosed |