Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 16/20 | 0.43 |
| ▸ | CA9 | Q16790 | 12/20 | 0.43 |
| ▸ | CA1 | P00915 | 10/20 | 0.43 |
| ▸ | CA12 | O43570 | 9/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1180536 | 0.79 | CYP3A4 (0.38) | TSHRCYP11B2 | |
| SCHEMBL4773979 | 0.79 | CA2 (0.56) | CA2CA9CA1CA12SMN1; SMN2 | |
| SCHEMBL28083685 | 0.75 | MKNK1 (0.35) | CYP11B2 | |
| SCHEMBL21808798 | 0.74 | CYP3A4 (0.49) | CYP11B2 | |
| SCHEMBL12502235 | 0.70 | CHRNB2 (0.33) | — | |
| SCHEMBL17686065 | 0.68 | CA2 (0.61) | CA2CA9CA1CA12CA5A | |
| SCHEMBL5733424 | 0.68 | HCAR2 (0.32) | — | |
| SCHEMBL12502665 | 0.67 | CYP11B1 (0.35) | CYP11B2 | |
| SCHEMBL8979701 | 0.67 | MKNK1 (0.37) | SMN1; SMN2CYP11B2 | |
| SCHEMBL13742989 | 0.67 | CA2 (0.57) | CA2CA9CA1CA12SMN1; SMN2 |
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-105829308-B | Isochromene derivatives as phosphoinositide 3-kinase inhibitors | 奇斯药制品公司 | 2019-03-08 | — | — | CN | disclosed |
| CN-105829308-A | Isochromene derivatives as phosphoinositide 3-kinase inhibitors | 奇斯药制品公司 | 2016-08-03 | — | — | CN | disclosed |