Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 15/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | GOT1 | P17174 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL28877285 | 0.77 | EGFR (0.55) | MAPK14EGFRKDRNPC1RAB9A | |
| SCHEMBL1416745 | 0.76 | TRPA1 (0.55) | MAPK14NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1673296 | 0.75 | KDM4E (0.55) | EGFRKDRNPC1RAB9AKMT2A | |
| SCHEMBL30523852 | 0.75 | KDM4E (0.55) | EGFRKDRNPC1RAB9AKMT2A | |
| SCHEMBL3258038 | 0.75 | TRPA1 (0.54) | MAPK14NPC1RAB9AMEN1KMT2A | |
| SCHEMBL30632058 | 0.73 | SMN1; SMN2 (0.47) | MAPK14EGFRKDRNPC1RAB9A | |
| SCHEMBL2228819 | 0.73 | SMN1; SMN2 (0.47) | MAPK14EGFRKDRNPC1RAB9A | |
| SCHEMBL13911023 | 0.72 | KDM4E (0.52) | EGFRKDRNPC1RAB9AKMT2A | |
| SCHEMBL28848755 | 0.71 | CYP3A4 (0.41) | MAPK14EGFRKDRNPC1RAB9A | |
| SCHEMBL3884938 | 0.71 | ALDH1A1 (0.39) | NPC1RAB9AMEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260245-A | Iridium metal complex, application thereof and organic electroluminescent device | 清华大学 | 2022-11-01 | — | — | CN | disclosed |