Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 6/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | STAT3 | P40763 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4948774 | 1.00 | CYP1A2 (0.67) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL4953490 | 0.92 | ALDH1A1 (0.62) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL4953500 | 0.92 | ALDH1A1 (0.62) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL5469106 | 0.88 | ALDH1A1 (0.65) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL31005217 | 0.85 | CYP1A2 (0.78) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL4788494 | 0.85 | CYP1A2 (0.78) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL29019314 | 0.83 | ALDH1A1 (0.75) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL30305355 | 0.83 | ALDH1A1 (0.75) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL31174251 | 0.81 | MEN1 (0.48) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL3563963 | 0.81 | CYP1A2 (0.68) | CYP1A2ALDH1A1HTTMEN1KMT2A |
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-7385064-B1 | Catalysts for use in enantioselective synthesis | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK | 2008-06-10 | — | — | US | disclosed |