Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | CA1 | P00915 | 6/20 | 0.59 |
| ▸ | CA2 | P00918 | 6/20 | 0.59 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.57 |
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.57 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.57 |
| ▸ | PLK1 | P53350 | 1/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2122823 | 0.81 | CES2 (0.59) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL7896809 | 0.81 | CES2 (0.59) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL17303366 | 0.79 | APP (0.58) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL10428864 | 0.78 | CA1 (0.59) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL28140959 | 0.77 | CES2 (0.82) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL27901877 | 0.77 | MAPT (0.55) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL4934444 | 0.77 | CES2 (0.54) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL557152 | 0.77 | CES2 (1.00) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL14507040 | 0.77 | CES2 (1.00) | CES2CES1CA1CA2PARP10 | |
| SCHEMBL51509 | 0.77 | RXFP1 (0.79) | CES2CES1CA1CA2PARP10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023178809-A1 | SYNTHESIS METHOD FOR NUCIFERINE OR DERIVATIVE THEREOF, NUCIFERINE DERIVATIVE AND APPLICATION THEREOF | 华侨大学 | 2023-09-28 | — | — | WO | disclosed |
| US-4579684-A | Process for the manufacture of enol derivatives | CIBA-GEIGY CORPORATION (US) | 1986-04-01 | — | — | US | disclosed |