Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | NPY2R | P49146 | 1/20 | 0.37 |
| ▸ | PRKCA | P17252 | 1/20 | 0.37 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 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 | |
|---|---|---|---|---|
| SCHEMBL7730011 | 0.82 | ATM (0.50) | ALDH1A1LMNACNR1CNR2PKM | |
| SCHEMBL7724597 | 0.81 | ALDH1A1 (0.35) | ALDH1A1LMNAMAPTTDP1L3MBTL1 | |
| SCHEMBL7725794 | 0.80 | L3MBTL1 (0.38) | PKMTDP1L3MBTL1KMT2A | |
| SCHEMBL7724618 | 0.79 | MAPT (0.38) | ALDH1A1MAPTTDP1KDM4EMAPK1 | |
| SCHEMBL14209814 | 0.78 | BTN3A1 (0.37) | ALDH1A1MAPTATMBTN3A1TDP1 | |
| SCHEMBL7723373 | 0.77 | ALDH1A1 (0.47) | ALDH1A1LMNAPKMMAPTL3MBTL1 | |
| SCHEMBL14700383 | 0.76 | CASP1 (0.37) | ALDH1A1ATMBTN3A1L3MBTL1RECQL | |
| SCHEMBL3248361 | 0.76 | KMT2A (0.50) | ALDH1A1LMNAATML3MBTL1SLC6A3 | |
| SCHEMBL7724591 | 0.76 | ALOX5 (0.38) | ALDH1A1LMNAPKMKMT2A | |
| SCHEMBL19726542 | 0.76 | KMT2A (0.50) | ALDH1A1LMNAATML3MBTL1SLC6A3 |
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-6403818-B1 | ONE POT PROCESS STARTING FROM CARBONYL COMPOUND, ALCOHOL, THIOL OR AMINE, AND PROTECTED HYDROXYDICYANO COMPOUND | EISAI CO., LTD. (JP) | 2002-06-11 | — | — | US | disclosed |