Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL30302886 | 0.85 | KDR (0.38) | NPC1RAB9ALMNACYP1A2CYP3A4 | |
| SCHEMBL22157558 | 0.85 | KDR (0.38) | NPC1RAB9ALMNACYP1A2CYP3A4 | |
| SCHEMBL30302652 | 0.83 | CHRNB2 (0.41) | NPC1RAB9AKMT2AMEN1CYP3A4 | |
| SCHEMBL22189188 | 0.83 | CHRNB2 (0.41) | NPC1RAB9AKMT2AMEN1CYP3A4 | |
| SCHEMBL30332820 | 0.82 | HPGD (0.37) | NPC1RAB9ALMNAMAPTKDM4E | |
| SCHEMBL22189183 | 0.81 | PDGFRB (0.42) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL30021723 | 0.81 | PDGFRB (0.42) | NPC1RAB9AKMT2AMEN1CYP1A2 | |
| SCHEMBL30021673 | 0.79 | NPC1 (0.34) | NPC1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL30021310 | 0.78 | MAP3K9 (0.39) | NPC1RAB9AIDO1TDO2 | |
| SCHEMBL30103693 | 0.76 | SQOR (0.33) | NPC1RAB9AMAPTHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022244864-A1 | MIXED POWDER, VAPOR DEPOSITION METHOD FOR ORGANIC COMPOUND, METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR SELECTING ORGANIC COMPOUND, AND VAPOR DEPOSITION METHOD | 出光興産株式会社 | 2022-11-24 | — | — | WO | disclosed |