Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.48 |
| ▸ | CA1 | P00915 | 9/20 | 0.48 |
| ▸ | CA9 | Q16790 | 8/20 | 0.48 |
| ▸ | CA5A | P35218 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 7/20 | 0.39 |
| ▸ | CA4 | P22748 | 3/20 | 0.39 |
| ▸ | CA6 | P23280 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.39 |
| ▸ | CA3 | P07451 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 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 | |
|---|---|---|---|---|
| SCHEMBL8578946 | 0.88 | CA2 (0.50) | CA2CA1CA9CA5ACYP1A2 | |
| SCHEMBL8582974 | 0.87 | CDK1 (0.38) | CA2CA1CA9CA5ACDK1 | |
| SCHEMBL8573646 | 0.86 | CA2 (0.48) | CA2CA1CA9CA5ACDK1 | |
| SCHEMBL8581893 | 0.84 | CA2 (0.47) | CA2CA1CA9CA5ACYP1A2 | |
| SCHEMBL8575183 | 0.82 | CA2 (0.44) | CA2CA1CA9CA5ACDK1 | |
| SCHEMBL8583213 | 0.82 | CA2 (0.44) | CA2CA1CA9CA5ACA12 | |
| SCHEMBL8608328 | 0.81 | CA2 (0.44) | CA2CA1CA9CA5ACYP1A2 | |
| SCHEMBL8581561 | 0.79 | CA2 (0.50) | CA2CA1CA9CA5ACYP1A2 | |
| SCHEMBL8580018 | 0.79 | CA2 (0.53) | CA2CA1CA9CA5ACYP1A2 | |
| SCHEMBL8532863 | 0.78 | SLC9A1 (0.52) | — |
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-5840761-A | Alkylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-11-24 | — | — | US | disclosed |