Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | METAP2 | P50579 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 6/20 | 0.39 |
| ▸ | RXRB | P28702 | 5/20 | 0.39 |
| ▸ | RXRG | P48443 | 4/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3658748 | 0.98 | ALDH1A1 (0.44) | ALDH1A1METAP2CYP1A2RXRARXRB | |
| SCHEMBL564223 | 0.94 | METAP2 (0.47) | ALDH1A1METAP2CYP1A2RXRARXRB | |
| SCHEMBL720289 | 0.93 | METAP2 (0.46) | ALDH1A1METAP2CYP1A2RXRARXRB | |
| SCHEMBL719871 | 0.93 | METAP2 (0.46) | ALDH1A1METAP2CYP1A2RXRARXRB | |
| SCHEMBL967549 | 0.89 | CYP1A2 (0.44) | ALDH1A1METAP2CYP1A2KDM4EHPGD | |
| Terephthalic Acid SCHEMBL5393223 | 0.88 | ALDH1A1 (0.47) | ALDH1A1METAP2RXRARXRBRXRG | |
| Cyclohexane SCHEMBL5999616 | 0.87 | CYP1A2 (0.38) | ALDH1A1METAP2CYP1A2MEN1KMT2A | |
| SCHEMBL196225 | 0.86 | CYP1A2 (0.41) | ALDH1A1METAP2CYP1A2KDM4EHPGD | |
| SCHEMBL819555 | 0.85 | METAP2 (0.48) | ALDH1A1METAP2CYP1A2RXRARXRB | |
| SCHEMBL251512 | 0.84 | CYP1A2 (0.57) | ALDH1A1CYP1A2RXRARXRBRXRG |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110003100-A1 | POLYESTER COMPOSITION AND POLYESTER MOLDED ARTICLE COMPRISING THE SAME | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 2011-01-06 | — | — | US | disclosed |