Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.74 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9115584 | 0.85 | GPR35 (1.00) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL9112380 | 0.85 | GPR35 (0.83) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL9226136 | 0.83 | GPR35 (0.74) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL6010888 | 0.82 | GPR35 (0.61) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL3650611 | 0.80 | TDP1 (0.61) | GPR35TDP1ALDH1A1TSHRHPGD | |
| SCHEMBL29939725 | 0.80 | TDP1 (0.61) | GPR35TDP1ALDH1A1TSHRHPGD | |
| SCHEMBL8083889 | 0.80 | GPR35 (0.58) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL8082966 | 0.78 | GPR35 (0.56) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL6815361 | 0.78 | GPR35 (0.56) | GPR35TDP1KDM4EMEN1MAPT | |
| SCHEMBL10599169 | 0.78 | GPR35 (0.56) | GPR35TDP1KDM4EMEN1MAPT |
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-118465140-B | Rapid detection method for aromatic nitrogen-containing disinfection byproducts in biological tissues | 同济大学 | 2024-11-05 | — | — | CN | disclosed |
| CN-118465140-A | Rapid detection method for aromatic nitrogen-containing disinfection byproducts in biological tissues | 同济大学 | 2024-08-09 | — | — | CN | disclosed |