Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 6/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 6/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 Butyl Ester SCHEMBL4872777 | 0.94 | ALDH1A1 (0.78) | ALDH1A1TSHRHPGDATMHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL17797774 | 0.94 | ALDH1A1 (0.78) | ALDH1A1TSHRHPGDATMHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL3830941 | 0.91 | ALDH1A1 (0.67) | ALDH1A1TSHRHPGDATMTHRB | |
| Acetic Acid Butyl Ester SCHEMBL99360 | 0.91 | ALDH1A1 (0.67) | ALDH1A1TSHRHPGDATMTHRB | |
| Acetic Acid Butyl Ester SCHEMBL11586521 | 0.91 | ALDH1A1 (0.67) | ALDH1A1TSHRHPGDATMTHRB | |
| Ethylene Glycol SCHEMBL10904075 | 0.90 | ALDH1A1 (0.65) | ALDH1A1TSHRHPGDATMMEN1 | |
| Acetic Acid Butyl Ester SCHEMBL1181041 | 0.90 | ALDH1A1 (0.72) | ALDH1A1TSHRHPGDATMMEN1 | |
| Acetic Acid Butyl Ester SCHEMBL28064789 | 0.90 | ALDH1A1 (0.86) | ALDH1A1TSHRHPGDATMCES2 | |
| Acetic Acid Butyl Ester SCHEMBL117774 | 0.90 | ALDH1A1 (0.86) | ALDH1A1TSHRHPGDATMHCAR2 | |
| Butoxyethanol SCHEMBL14157136 | 0.89 | TSHR (0.65) | ALDH1A1TSHRHPGDATMMEN1 |
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-1828322-B1 | LIQUID COATING COMPOSITIONS THAT INCLUDE A COMPOUND FORMED FROM AT LEAST ONE POLYFUNCTIONAL ISOCYANURATE, RELATED MULTI-LAYER COMPOSITE COATINGS, METHODS AND COATED SUBSTRATES | PPG IND OHIO INC (US) | 2009-12-23 | — | — | EP | disclosed |
| EP-1828322-A2 | LIQUID COATING COMPOSITIONS THAT INCLUDE A COMPOUND FORMED FROM AT LEAST ONE POLYFUNCTIONAL ISOCYANURATE, RELATED MULTI-LAYER COMPOSITE COATINGS, METHODS AND COATED SUBSTRATES | PPG Industries Ohio, Inc. (US) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006047666-A2 | LIQUID COATING COMPOSITIONS THAT INCLUDE A COMPOUND FORMED FROM AT LEAST ONE POLYFUNCTIONAL ISOCYANURATE, RELATED MULTI-LAYER COMPOSITE COATINGS, METHODS AND COATED SUBSTRATES | PPG INDUSTRIES OHIO, INC. (US) | 2006-05-04 | — | — | WO | disclosed |
| US-20060089452-A1 | Liquid coating compositions that include a compound formed from at least one polyfunctional isocyanurate, related multi-layer composite coatings, methods and coated substrates | PPG INDUSTRIES OHIO, INC. | 2006-04-27 | — | — | US | disclosed |