Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.35 |
| ▸ | CA1 | P00915 | 7/20 | 0.35 |
| ▸ | CA2 | P00918 | 7/20 | 0.35 |
| ▸ | CA6 | P23280 | 7/20 | 0.35 |
| ▸ | CA5A | P35218 | 7/20 | 0.35 |
| ▸ | CA7 | P43166 | 7/20 | 0.35 |
| ▸ | CA9 | Q16790 | 7/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 7/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 7/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 7/20 | 0.35 |
| ▸ | CA4 | P22748 | 6/20 | 0.35 |
| ▸ | COMT | P21964 | 2/20 | 0.34 |
| ▸ | CA3 | P07451 | 6/20 | 0.34 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.33 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8544558 | 0.99 | CA12 (0.37) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8543067 | 0.99 | CA12 (0.37) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8537147 | 0.97 | CA12 (0.33) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8538263 | 0.95 | CCR2 (0.35) | DDR1SLC9A1KCNH2CNR2EPHX2 | |
| SCHEMBL8543281 | 0.85 | CA12 (0.37) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8538609 | 0.84 | CA12 (0.39) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8538974 | 0.84 | CA12 (0.39) | CA12CA1CA2CA6CA5A | |
| SCHEMBL8541311 | 0.83 | TAS1R3 (0.34) | DDR1SLC9A1KCNH2CNR2CNR1 | |
| SCHEMBL8540501 | 0.82 | CA12 (0.35) | CA12CA1CA2CA6CA5A | |
| SCHEMBL6932145 | 0.82 | SLC9A1 (0.53) | SLC9A1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5744641-A | Sulfonyl- or sulfinylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-28 | — | — | US | disclosed |