Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28503156 | 0.90 | EGFR (0.52) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL3422644 | 0.80 | CA12 (0.54) | TDP1KDM4EALDH1A1MAPTGAA | |
| SCHEMBL8678283 | 0.79 | KDM4E (0.59) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL29575047 | 0.77 | TDP1 (0.61) | TDP1KDM4EALDH1A1MAPTGAA | |
| SCHEMBL21261147 | 0.76 | EGFR (0.62) | TDP1EGFRKDM4EALDH1A1MAPT | |
| SCHEMBL68818 | 0.76 | SLC6A3 (0.73) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL28255681 | 0.76 | SLC2A1 (0.63) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL9423312 | 0.75 | TDP1 (0.59) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL30571934 | 0.75 | TDP1 (0.59) | TDP1EGFRKDM4ECYP1A2CYP2D6 | |
| SCHEMBL6888946 | 0.75 | EGFR (0.57) | TDP1EGFRKDM4EALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-8658562-B2 | Method for hydrothermal preparation of metal-organic framework crystallised porous aluminium carboxylates | Centre National de la Recherche Scientifique—CNRS (FR) | 2014-02-25 | — | — | US | claimed |
| US-20120055880-A1 | METHOD FOR HYDROTHERMAL PREPARATION OF METAL-ORGANIC FRAMEWORK CRYSTALLISED POROUS ALUMINIUM CARBOXYLATES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) | 2012-03-08 | — | — | US | claimed |
| US-8658562-B2 | Method for hydrothermal preparation of metal-organic framework crystallised porous aluminium carboxylates | Centre National de la Recherche Scientifique—CNRS (FR) | 2014-02-25 | — | — | US | disclosed |
| US-20120055880-A1 | METHOD FOR HYDROTHERMAL PREPARATION OF METAL-ORGANIC FRAMEWORK CRYSTALLISED POROUS ALUMINIUM CARBOXYLATES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) | 2012-03-08 | — | — | US | disclosed |