Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FES | P07332 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | MARK3 | P27448 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7547160 | 0.77 | CYP1A2 (0.45) | CYP1A2CYP2D6LMNARECQLALDH1A1 | |
| SCHEMBL7547164 | 0.77 | CYP1A2 (0.45) | CYP1A2CYP2D6LMNARECQLALDH1A1 | |
| SCHEMBL1310957 | 0.75 | KMT2A (0.38) | LMNAALDH1A1POLBL3MBTL1CHRM2 | |
| SCHEMBL1310330 | 0.75 | SMN1; SMN2 (0.39) | LMNAALDH1A1USP2POLBL3MBTL1 | |
| SCHEMBL1310266 | 0.72 | ALDH1A1 (0.52) | ALDH1A1USP2POLBNPC1RAB9A | |
| SCHEMBL348709 | 0.72 | CYP1A2 (0.68) | CYP1A2CYP2D6LMNARECQLALDH1A1 | |
| SCHEMBL14972765 | 0.71 | CYP1A2 (0.45) | CYP1A2CYP2D6LMNARECQLALDH1A1 | |
| SCHEMBL3160679 | 0.69 | CYP1A2 (0.62) | CYP1A2CYP2D6LMNARECQLCTSL | |
| SCHEMBL26780009 | 0.69 | CYP1A2 (0.62) | CYP1A2CYP2D6LMNARECQLCTSL | |
| SCHEMBL15065573 | 0.66 | CYP1A2 (0.58) | CYP1A2CYP2D6LMNARECQLCTSL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8846125-B2 | Enaminocarbonyl compounds and their use | INSTYTUT CHEMII ORGANICZNEJ, POLSKA AKADEMIA NAUK (PL) | 2014-09-30 | — | — | US | claimed |
| EP-2391614-B1 | ENAMINOCARBONYL COMPOUNDS AND THEIR USE | INST CHEMII ORGANICZNEJ POLSKA AKADEMIA NAUK (PL) | 2013-05-29 | — | — | EP | claimed |
| EP-2391614-B1 | ENAMINOCARBONYL COMPOUNDS AND THEIR USE | INST CHEMII ORGANICZNEJ POLSKA AKADEMIA NAUK (PL) | 2013-05-29 | — | — | EP | disclosed |