Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.56 |
| ▸ | RAB9A | P51151 | 7/20 | 0.56 |
| ▸ | APP | P05067 | 5/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | ALDH1A3 | P47895 | 8/20 | 0.52 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.52 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL972253 | 0.85 | NPC1 (0.57) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL973772 | 0.83 | ALDH1A3 (0.48) | NPC1RAB9AKDM4EPAX8ALDH1A1 | |
| SCHEMBL970956 | 0.81 | ALDH1A3 (0.67) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL974462 | 0.80 | ALDH1A1 (0.63) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL973129 | 0.79 | ALDH1A3 (0.84) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL971185 | 0.78 | ALDH1A3 (0.77) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL7605200 | 0.76 | NPC1 (0.77) | NPC1RAB9AAPPKDM4EPOLB | |
| SCHEMBL895891 | 0.76 | CYP11B1 (0.50) | KDM4EALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL29596315 | 0.76 | CYP11B1 (0.50) | KDM4EALDH1A1KMT2AMEN1MAPT | |
| Bromide SCHEMBL1691457 | 0.75 | NPC1 (0.75) | NPC1RAB9AAPPKDM4EPOLB |
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-7867629-B2 | Nitrogenous heterocyclic derivative and organic electroluminescent element employing the same | IDEMITSU KOSAN CO., LTD. (JP) | 2011-01-11 | — | — | US | disclosed |