Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | CACNA1D | Q01668 | 6/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18544699 | 0.82 | ALDH1A1 (0.34) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL6268224 | 0.80 | CACNA1D (0.36) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL18732193 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL19061792 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL15450402 | 0.78 | ALDH1A1 (0.45) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL17759613 | 0.77 | CLK4 (0.42) | TSHR | |
| SCHEMBL17432493 | 0.77 | ALDH1A1 (0.35) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL16850477 | 0.76 | ALDH1A1 (0.37) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL18852236 | 0.76 | TNKS2 (0.38) | ALDH1A1HPGDRXFP1KDM4EKMT2A | |
| SCHEMBL15811001 | 0.76 | ALDH1A1 (0.35) | ALDH1A1HPGDRXFP1KDM4EKMT2A |
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-2019004587-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2019-01-03 | — | — | WO | disclosed |