Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 2/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 1/20 | 0.41 |
| ▸ | ACP1 | P24666 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30367038 | 0.85 | CYP1A2 (0.50) | KDM1AMAPTALDH1A1TDP1CYP1A2 | |
| SCHEMBL30367104 | 0.85 | CYP1A2 (0.50) | KDM1ACYP1A2NCF1EGFRPDGFRB | |
| SCHEMBL30367213 | 0.84 | CYP1A2 (0.49) | KDM1AMAPTALDH1A1CYP1A2CRHR1 | |
| SCHEMBL30367177 | 0.80 | CYP1A2 (0.47) | KDM1AMEN1KMT2ACYP1A2NCF1 | |
| SCHEMBL8894367 | 0.77 | CYP1A2 (0.50) | L3MBTL1MAPTCYP1A2CRHR1NCF1 | |
| SCHEMBL23037532 | 0.76 | MAPT (0.48) | KDM1AL3MBTL1MAPTMAPK1MEN1 | |
| SCHEMBL30366693 | 0.76 | LMNA (0.49) | MAPTCYP1A2EGFRPDGFRBKDR | |
| SCHEMBL6790532 | 0.75 | CYP1A2 (0.60) | KDM1AL3MBTL1MAPTUSP2ALDH1A1 | |
| SCHEMBL23037554 | 0.75 | CYP1A2 (0.42) | MAPTMEN1ALDH1A1KMT2AATM | |
| SCHEMBL21883075 | 0.74 | MAPT (0.43) | L3MBTL1MAPTMEN1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111825610-B | 2-methylquinoline derivative with anti-tumor activity and synthesis method and application thereof | 中国药科大学 | 2023-03-31 | — | — | CN | disclosed |