Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21415943 | 0.85 | MEN1 (0.31) | MEN1CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL23072568 | 0.80 | MEN1 (0.33) | MEN1CYP2C19KMT2APGR | |
| SCHEMBL21036897 | 0.77 | MEN1 (0.34) | MEN1CYP2C19KMT2APGR | |
| SCHEMBL23017573 | 0.77 | MEN1 (0.34) | MEN1CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL14878701 | 0.77 | MEN1 (0.34) | MEN1CYP2C19KMT2ANPC1RAB9A | |
| SCHEMBL14819936 | 0.74 | MEN1 (0.31) | MEN1CYP2C19KMT2A | |
| SCHEMBL22751115 | 0.73 | MEN1 (0.31) | MEN1CYP2C19KMT2A | |
| SCHEMBL21037795 | 0.71 | CYP1A2 (0.30) | KMT2A | |
| SCHEMBL24219817 | 0.71 | NPC1 (0.30) | NPC1RAB9A | |
| SCHEMBL16558106 | 0.68 | HRH4 (0.36) | MEN1CYP2C19KMT2ANPC1RAB9A |
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-9978952-B2 | Fused heterocyclic aromatic derivative, organic electroluminescence element material, and organic electroluminescence element using same | IDEMITSU KOSAN CO., LTD. (JP) | 2018-05-22 | — | — | US | disclosed |