Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 7/20 | 0.39 |
| ▸ | EP300 | Q09472 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | BPTF | Q12830 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | BAZ2B | Q9UIF8 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19413464 | 0.88 | ALDH1A1 (0.43) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL17232730 | 0.80 | SHMT2 (0.42) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL26373654 | 0.79 | MAPT (0.41) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL16127294 | 0.79 | NOTUM (0.41) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL17229773 | 0.77 | BAZ2B (0.38) | CREBBPEP300BPTFNOTUMMAPT | |
| SCHEMBL17518307 | 0.71 | BPTF (0.46) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL19413417 | 0.71 | CREBBP (0.58) | CREBBPEP300MAPTBAZ2BLMNA | |
| SCHEMBL17234800 | 0.71 | CREBBP (0.51) | CREBBPEP300BRD4 | |
| SCHEMBL24045546 | 0.68 | SHMT2 (0.42) | CREBBPEP300ALDH1A1L3MBTL1BPTF | |
| SCHEMBL17234782 | 0.68 | CREBBP (0.43) | CREBBPEP300BRD4 |
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-9938291-B2 | N-alkyl-2-phenoxyethanamines, their preparation and use | THE TRUSTESS OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2018-04-10 | — | — | US | disclosed |