Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.72 |
| ▸ | HPGD | P15428 | 3/20 | 0.72 |
| ▸ | MAPT | P10636 | 2/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.49 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8866260 | 0.84 | KDM4E (1.00) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| SCHEMBL24203623 | 0.84 | KDM4E (0.81) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| SCHEMBL5087465 | 0.77 | MAP2K2 (0.65) | ALDH1A1KDM4EHPGDMAPTMAP2K2 | |
| SCHEMBL2034515 | 0.76 | PDE7A (0.69) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| SCHEMBL8387640 | 0.76 | MAOA (0.53) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| Hydrochloric Acid SCHEMBL7611960 | 0.75 | PDE7A (0.67) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| SCHEMBL8563632 | 0.73 | CYP3A4 (0.61) | ALDH1A1KDM4EMAPTCYP3A4MEN1 | |
| SCHEMBL18938570 | 0.72 | MAP2K2 (0.54) | ALDH1A1HPGDMAP2K2MAP2K1CA1 | |
| SCHEMBL8866407 | 0.71 | KDM4E (0.76) | ALDH1A1KDM4EHPGDMAPTCYP3A4 | |
| SCHEMBL4071356 | 0.71 | MAOB (0.49) | ALDH1A1KDM4EHPGDMAPTCYP3A4 |
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-109651208-B | N-aryl sulfonamide compound, pharmaceutical composition and application thereof | 中国科学院上海药物研究所 | 2022-01-04 | — | — | CN | disclosed |
| CN-109651208-A | N- arylsulfonamides compound, medical composition and its use | 中国科学院上海药物研究所 | 2019-04-19 | — | — | CN | disclosed |