Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670297 | 0.95 | ASAH1 (0.41) | CA12CA1CA2CA9CHRM2 | |
| SCHEMBL19670650 | 0.94 | ASAH1 (0.44) | CA12CA1CA2CA9CHRM2 | |
| SCHEMBL19365629 | 0.89 | CHRM4 (0.41) | CHRM2CHRM4KMONAMPT | |
| SCHEMBL16238924 | 0.85 | TP53 (0.42) | CA12CA1CA2CA9CHRM2 | |
| SCHEMBL19670281 | 0.85 | LMNA (0.47) | TRPV4CNR2TSHR | |
| SCHEMBL19670497 | 0.83 | MAPT (0.45) | TSHRKMT2A | |
| SCHEMBL19670437 | 0.82 | MAPK1 (0.42) | NAMPT | |
| SCHEMBL19365390 | 0.81 | DGAT2 (0.43) | CHRM2CHRM4CNR2TSHRKMT2A | |
| SCHEMBL17618776 | 0.81 | ASAH1 (0.40) | CA12CA1CA2CA9CHRM2 | |
| SCHEMBL17618777 | 0.80 | ASAH1 (0.42) | CA12CA1CA2CA9CHRM2 |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |