Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL628189 | 0.81 | CYP3A4 (0.42) | CYP3A4ALDH1A1TDP1HPGDKDM4E | |
| SCHEMBL29648867 | 0.81 | CYP3A4 (0.42) | CYP3A4ALDH1A1TDP1HPGDKDM4E | |
| SCHEMBL6118482 | 0.81 | ALDH1A1 (0.43) | CYP3A4ALDH1A1TDP1IRAK4HPGD | |
| SCHEMBL31540602 | 0.81 | ALDH1A1 (0.43) | CYP3A4ALDH1A1TDP1IRAK4HPGD | |
| SCHEMBL15321040 | 0.80 | CYP3A4 (0.46) | CYP3A4ALDH1A1TDP1IRAK4HPGD | |
| SCHEMBL77114 | 0.79 | ALDH1A1 (0.61) | CYP3A4ALDH1A1TDP1HPGDMAPT | |
| SCHEMBL29471398 | 0.79 | ALDH1A1 (0.61) | CYP3A4ALDH1A1TDP1HPGDMAPT | |
| SCHEMBL1356140 | 0.78 | CYP3A4 (0.50) | CYP3A4ALDH1A1TDP1HPGDTRPA1 | |
| SCHEMBL29369823 | 0.78 | CYP3A4 (0.50) | CYP3A4ALDH1A1TDP1HPGDTRPA1 | |
| SCHEMBL9622718 | 0.77 | CYP3A4 (0.43) | CYP3A4ALDH1A1TDP1HPGDMAPT |
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-0271914-B1 | POLYESTERAMIDE WITH IMPROVED COMPRESSION SET | THE DOW CHEMICAL COMPANY (US) | 1992-01-08 | — | — | EP | disclosed |
| US-4772649-A | Polyesteramide and sufficient carbodiimide to impart improved compression set | THE DOW CHEMICAL COMPANY (US) | 1988-09-20 | — | — | US | disclosed |
| EP-0271914-A2 | Polyesteramide with improved compression set | THE DOW CHEMICAL COMPANY (US) | 1988-06-22 | — | — | EP | disclosed |
| US-4174393-A | INSECTICIDES | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1979-11-13 | — | — | US | disclosed |