Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CAMKK1 | Q8N5S9 | 2/20 | 0.32 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16066528 | 0.92 | ALDH1A1 (0.38) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066934 | 0.92 | HPGD (0.40) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066196 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066604 | 0.90 | ALDH1A1 (0.38) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066958 | 0.90 | ALDH1A1 (0.39) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066919 | 0.89 | HPGD (0.42) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066669 | 0.88 | HPGD (0.41) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066751 | 0.85 | ALDH1A1 (0.38) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16066976 | 0.85 | ALDH1A1 (0.39) | ALDH1A1KMT2AHPGDSMN1; SMN2KDM4E | |
| SCHEMBL17033537 | 0.84 | KDM4E (0.33) | ALDH1A1KMT2ASMN1; SMN2KDM4EMAPT |
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-2014142488-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME | 주식회사 두산 (KR) | 2014-09-18 | — | — | WO | disclosed |