Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 10/20 | 0.42 |
| ▸ | CA1 | P00915 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | NEK2 | P51955 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | IKBKB | O14920 | 2/20 | 0.33 |
| ▸ | CHUK | O15111 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14061195 | 0.83 | CA2 (0.39) | CA2CA1CA9CA12CDK8 | |
| SCHEMBL31265094 | 0.76 | REN (0.38) | IKBKBCHUKBRD4DAO | |
| SCHEMBL11101358 | 0.74 | KMT2A (0.41) | IKBKBCHUKBRD4NR3C1PGR | |
| SCHEMBL14061194 | 0.74 | CA2 (0.39) | CA2CA1CA9CA12CDK8 | |
| SCHEMBL23735763 | 0.73 | USP2 (0.41) | IKBKBCHUKBRD4DAO | |
| SCHEMBL2536694 | 0.73 | AHR (0.41) | IKBKBCHUKBRD4DAO | |
| SCHEMBL21921427 | 0.73 | AHR (0.41) | IKBKBCHUKBRD4NR3C1PGR | |
| SCHEMBL24165715 | 0.70 | MEN1 (0.43) | CDK2IKBKBCHUK | |
| SCHEMBL18299451 | 0.69 | MPO (0.36) | SMN1; SMN2PGR | |
| SCHEMBL6188803 | 0.67 | CA2 (0.57) | CA2CA1CA9CA12LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103732589-B | Can be used as the sulphonamide of the replacement of anti-apoptotic BCL inhibitor | BRISTOL-MYERS SQUIBB CO. (US) | 2016-03-30 | — | — | CN | disclosed |