Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KLK7 | P49862 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL212215 | 0.90 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1CYP1A2NPSR1KMT2A | |
| SCHEMBL7438726 | 0.87 | NPC1 (0.45) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL1413274 | 0.86 | FABP7 (0.44) | ALDH1A1L3MBTL1NPSR1MAPTMEN1 | |
| SCHEMBL6285272 | 0.84 | CNR2 (0.50) | ALDH1A1KLK7MEN1KMT2APOLB | |
| SCHEMBL5183992 | 0.84 | ATM (0.55) | ALDH1A1KLK7MAPTMEN1KMT2A | |
| SCHEMBL9054330 | 0.83 | HCAR2 (0.47) | ALDH1A1CYP3A4LMNATACR1MMP1 | |
| SCHEMBL5481199 | 0.82 | RAB9A (0.49) | NPSR1MAPTKMT2A | |
| SCHEMBL7425721 | 0.80 | L3MBTL1 (0.41) | ALDH1A1L3MBTL1NPSR1KLK7MEN1 | |
| SCHEMBL1521950 | 0.78 | CA1 (0.50) | ALDH1A1L3MBTL1MEN1KMT2ACNR2 | |
| SCHEMBL5050204 | 0.78 | IDO1 (0.38) | ALDH1A1CYP1A2CYP3A4MEN1KMT2A |
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-5580984-A | 1-OXA-3-AZA-2-BORINE INTERMEDIATES | ABBOTT LABORATORIES (US) | 1996-12-03 | — | — | US | disclosed |