Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 12/20 | 0.92 |
| ▸ | CA2 | P00918 | 12/20 | 0.92 |
| ▸ | CA9 | Q16790 | 12/20 | 0.92 |
| ▸ | CA7 | P43166 | 11/20 | 0.92 |
| ▸ | CA12 | O43570 | 11/20 | 0.92 |
| ▸ | CA14 | Q9ULX7 | 9/20 | 0.92 |
| ▸ | MEN1 | O00255 | 3/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.74 |
| ▸ | SLC6A7 | Q99884 | 2/20 | 0.74 |
| ▸ | POLB | P06746 | 2/20 | 0.74 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL28014906 | 0.89 | CA1 (0.73) | CA1CA2CA9CA7CA12 | |
| SCHEMBL8161635 | 0.86 | SLC6A7 (1.00) | CA1CA2CA9CA7CA12 | |
| SCHEMBL28217169 | 0.84 | CA12 (0.69) | CA1CA2CA9CA7CA12 | |
| SCHEMBL10721777 | 0.83 | MEN1 (0.87) | CA1CA2CA9CA7CA12 | |
| SCHEMBL14493373 | 0.83 | CA12 (0.87) | CA1CA2CA9CA7CA12 | |
| SCHEMBL5632669 | 0.80 | SLC6A7 (0.67) | CA1CA2CA9CA7CA12 | |
| SCHEMBL8595777 | 0.80 | POLB (0.87) | CA1CA2CA9CA7CA12 | |
| SCHEMBL3276407 | 0.79 | MEN1 (0.74) | CA1CA2CA9CA7CA12 | |
| SCHEMBL1711050 | 0.79 | MEN1 (0.74) | CA1CA2CA9CA7CA12 | |
| SCHEMBL3573771 | 0.77 | SLC6A7 (0.81) | MEN1KMT2ASLC6A7POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104817498-B | Therapeutic compound and composition | 安吉奥斯医药品有限公司 | 2018-06-01 | — | — | CN | disclosed |
| CN-104817498-A | Therapeutic compounds and compositions | AGIOS PHARMACEUTICALS INC | 2015-08-05 | — | — | CN | disclosed |
| CN-102481300-B | Therapeutic compounds and compositions | AGIOS PHARMACEUTICALS INC | 2015-04-15 | — | — | CN | disclosed |