Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | BCL2 | P10415 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.41 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.41 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.41 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9387675 | 0.90 | KAT2B (0.47) | KAT2BALDH1A1TSHRBCL2PPARG | |
| SCHEMBL28684653 | 0.87 | ALDH1A1 (0.49) | KAT2BALDH1A1TSHRBCL2PPARG | |
| SCHEMBL28684650 | 0.87 | ALDH1A1 (0.49) | KAT2BALDH1A1TSHRBCL2PPARG | |
| SCHEMBL9391766 | 0.86 | KAT2B (0.51) | KAT2BALDH1A1BCL2GSTP1GSTM2 | |
| SCHEMBL9391236 | 0.86 | KAT2B (0.57) | KAT2BALDH1A1FOLH1MAPT | |
| SCHEMBL9386630 | 0.85 | KAT2B (0.50) | KAT2BALDH1A1MAPT | |
| SCHEMBL9388577 | 0.84 | KAT2B (0.53) | KAT2BALDH1A1FOLH1MAPT | |
| SCHEMBL9387741 | 0.83 | KAT2B (0.46) | KAT2BALDH1A1TSHRBCL2MAPT | |
| SCHEMBL9386631 | 0.83 | KAT2B (0.46) | KAT2BALDH1A1TSHRBCL2MAPT | |
| SCHEMBL14981761 | 0.82 | KAT2B (0.58) | KAT2BALDH1A1TSHRGUCY1A1GUCY1B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1994012163-A1 | 2-NITROARYL AND 2-CYANOARYL COMPOUNDS AS REGULATORS OF NITRIC OXIDE SYNTHASE | ABBOTT LABORATORIES (US) | 1994-06-09 | — | — | WO | claimed |
| US-5362747-A | Promoters, inhibitors | ABBOTT LABORATORIES (US) | 1994-11-08 | — | — | US | disclosed |
| WO-1994012163-A1 | 2-NITROARYL AND 2-CYANOARYL COMPOUNDS AS REGULATORS OF NITRIC OXIDE SYNTHASE | ABBOTT LABORATORIES (US) | 1994-06-09 | — | — | WO | disclosed |