Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLD1 | Q13393 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HTR2B | P41595 | 4/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | REN | P00797 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28059226 | 0.88 | PLD1 (0.48) | PLD1ALDH1A1SMN1; SMN2ALOX5HTR2C | |
| SCHEMBL28059127 | 0.82 | KDM4E (0.44) | ALDH1A1SMN1; SMN2HTR2CHTR2BHTR2A | |
| SCHEMBL20140971 | 0.79 | SLC6A2 (0.53) | ALDH1A1HTR2CHTR2BHTR2AHSD17B10 | |
| SCHEMBL9396845 | 0.79 | SLC6A2 (0.53) | ALDH1A1HTR2CHTR2BHTR2AHSD17B10 | |
| Hydrochloric Acid SCHEMBL10773342 | 0.79 | PLD1 (0.44) | PLD1ALDH1A1SMN1; SMN2ALOX5CYP3A4 | |
| SCHEMBL21853236 | 0.78 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2CYP3A4CYP2C9HPGD | |
| SCHEMBL21853250 | 0.78 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2CYP3A4CYP2C9HPGD | |
| Hydrochloric Acid SCHEMBL20140710 | 0.78 | SLC6A2 (0.51) | ALDH1A1HTR2CHTR2BHTR2AHSD17B10 | |
| SCHEMBL27872676 | 0.77 | PLD1 (0.51) | PLD1ALDH1A1SMN1; SMN2ALOX5HTR2C | |
| SCHEMBL3319561 | 0.77 | PLD1 (0.51) | PLD1ALDH1A1SMN1; SMN2ALOX5HTR2C |
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-109641873-B | N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease | 诺华股份有限公司 | 2022-03-18 | — | — | CN | disclosed |