Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.68 |
| ▸ | CA1 | P00915 | 5/20 | 0.59 |
| ▸ | CA2 | P00918 | 5/20 | 0.59 |
| ▸ | CA12 | O43570 | 4/20 | 0.59 |
| ▸ | CA9 | Q16790 | 4/20 | 0.59 |
| ▸ | ERN1 | O75460 | 2/20 | 0.58 |
| ▸ | PLAU | P00749 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | CA7 | P43166 | 1/20 | 0.55 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.53 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.53 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.52 |
| ▸ | FNTA | P49354 | 1/20 | 0.52 |
| ▸ | FNTB | P49356 | 1/20 | 0.52 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL27589486 | 0.94 | TSHR (0.64) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL68931 | 0.92 | CA12 (0.69) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL10009170 | 0.90 | CA1 (0.61) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL16749645 | 0.90 | CA1 (0.61) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL6138470 | 0.89 | EGFR (0.60) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL4700092 | 0.89 | EGFR (0.65) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL31337006 | 0.89 | EGFR (0.65) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL31298127 | 0.89 | EGFR (0.60) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL28495999 | 0.88 | EGFR (0.73) | EGFRCA1CA2CA12CA9 | |
| SCHEMBL28931930 | 0.88 | EGFR (0.73) | EGFRCA1CA2CA12CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107540848-A | A kind of preparation and its application of efficiently out-phase hydrogen-bond donor MOF catalyst | 合肥工业大学 | 2018-01-05 | — | — | CN | claimed |
| CN-107540848-A | A kind of preparation and its application of efficiently out-phase hydrogen-bond donor MOF catalyst | 合肥工业大学 | 2018-01-05 | — | — | CN | disclosed |