Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 7/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6923000 | 0.82 | ALDH1A1 (0.42) | ALDH1A1MAPTLMNAMAOAMAOB | |
| SCHEMBL28940131 | 0.80 | PTPN11 (0.47) | MTNR1AMTNR1BALDH1A1MAPTTERT | |
| SCHEMBL6831024 | 0.74 | TERT (0.60) | MTNR1AMTNR1BALDH1A1MAPTLMNA | |
| SCHEMBL6924355 | 0.73 | ALDH1A1 (0.47) | ALDH1A1MAPTTSHRMEN1POLB | |
| SCHEMBL7126390 | 0.72 | DAO (0.49) | ALDH1A1MAPTLMNATERTTSHR | |
| SCHEMBL911004 | 0.72 | MTNR1A (0.52) | MTNR1AMTNR1BMAOAMAOBTERT | |
| SCHEMBL2549273 | 0.72 | PIK3CG (0.58) | ALDH1A1MAPTLMNATSHRMEN1 | |
| SCHEMBL7126318 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MAPTMAOAMAOBTSHR | |
| SCHEMBL7069576 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MAPTLMNAMAOAMAOB | |
| SCHEMBL9770325 | 0.69 | MTNR1A (0.64) | MTNR1AMTNR1BALDH1A1MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |