Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| 2-Ethylfuran SCHEMBL29159372 | 0.84 | — | — | |
| 2-Ethylfuran SCHEMBL28496480 | 0.82 | — | — | |
| 2-Ethylfuran SCHEMBL27805720 | 0.82 | — | — | |
| 2-Ethylfuran SCHEMBL25423480 | 0.77 | RAB9A (0.44) | CHRM2ALDH1A1MEN1KMT2AHPGD | |
| 2-Ethylfuran SCHEMBL27945022 | 0.77 | TP53 (0.65) | POLBCHRM2ALDH1A1HPGDTSHR | |
| 2-Ethylfuran SCHEMBL28064288 | 0.77 | ALDH1A1 (0.44) | POLBCHRM2ALDH1A1MEN1KMT2A | |
| 2-Ethylfuran SCHEMBL5801745 | 0.75 | POLB (0.49) | POLBCHRM2ALDH1A1MEN1KMT2A | |
| 2-Ethylfuran SCHEMBL27491633 | 0.75 | ALDH1A1 (0.56) | POLBALDH1A1TSHRRIPK1HSD17B10 | |
| 2-Ethylfuran SCHEMBL27782212 | 0.75 | ALDH1A1 (0.47) | POLBCHRM2ALDH1A1TSHRRIPK1 | |
| 2-Ethylfuran SCHEMBL29198005 | 0.73 | ALDH1A1 (0.50) | POLBALDH1A1TSHRRIPK1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109134463-B | β -carboline type 5 phosphodiesterase inhibitor and preparation method and application thereof | 山东大学 | 2020-05-08 | — | — | CN | disclosed |
| CN-109134463-A | 5 type phosphodiesterase inhibitors of B-carboline class and its preparation method and application | 山东大学 | 2019-01-04 | — | — | CN | disclosed |