Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 4/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 10/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL2907740 | 0.76 | CYP1A2 (0.52) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL1616630 | 0.76 | SCN9A (0.43) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL1615592 | 0.71 | PFKFB3 (0.42) | — | |
| SCHEMBL1616049 | 0.69 | LMNA (0.48) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL16717433 | 0.67 | ADORA1 (0.52) | KDM4ECYP1A2MAPTLMNAMEN1 | |
| SCHEMBL27303568 | 0.66 | KDR (0.49) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL3697880 | 0.66 | MAPT (0.51) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL27060737 | 0.65 | NCF1 (0.65) | KDM4ECYP1A2CYP2C19TDP1NCF1 | |
| SCHEMBL21217198 | 0.65 | NCF1 (0.53) | KDM4EMAPTTDP1NCF1LMNA | |
| Hydrochloric Acid SCHEMBL27300484 | 0.65 | MAPT (0.50) | KDM4ECYP1A2MAPTCYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2099763-B1 | 2-AMINOQUINOLINES AS 5-HT(5A) RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-08-11 | — | — | EP | disclosed |