Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 2/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20923602 | 0.97 | NPSR1 (0.40) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923155 | 0.96 | NPSR1 (0.36) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923205 | 0.94 | ALDH1A1 (0.38) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL22170307 | 0.93 | XDH (0.36) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923157 | 0.93 | KDM4E (0.38) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL22019653 | 0.93 | KDM4E (0.35) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923594 | 0.93 | XDH (0.35) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923725 | 0.92 | SQOR (0.38) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923595 | 0.92 | NPSR1 (0.40) | ALDH1A1NPSR1KDM4EMEN1KMT2A | |
| SCHEMBL20923437 | 0.91 | KDM4E (0.46) | ALDH1A1NPSR1KDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3266772-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-04-24 | — | — | EP | disclosed |