Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | PDE5A | O76074 | 10/20 | 0.43 |
| ▸ | PDE4A | P27815 | 4/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28211344 | 0.81 | CYP1A2 (0.42) | CYP1A2CYP2C9CYP2C19CYP19A1MEN1 | |
| SCHEMBL28211347 | 0.76 | CYP2D6 (0.54) | CYP1A2CYP2C9CYP2C19CYP19A1KDM4E | |
| SCHEMBL17292882 | 0.73 | CYP1A2 (0.62) | CYP1A2CYP2C9CYP2C19CYP19A1PDE5A | |
| SCHEMBL29365709 | 0.73 | CYP1A2 (0.62) | CYP1A2CYP2C9CYP2C19CYP19A1PDE5A | |
| SCHEMBL28928070 | 0.73 | CYP1A2 (0.62) | CYP1A2CYP2C9CYP2C19CYP19A1PDE5A | |
| SCHEMBL28205986 | 0.71 | DRD1 (0.45) | KDM4EMEN1KMT2AALDH1A1SMN1; SMN2 | |
| 1,2-Dibutoxybenzene SCHEMBL1226749 | 0.71 | CYP1A2 (0.72) | CYP1A2CYP2C9CYP2C19CYP19A1KDM4E | |
| 1,2-Dibutoxybenzene SCHEMBL29428927 | 0.71 | CYP1A2 (0.72) | CYP1A2CYP2C9CYP2C19CYP19A1KDM4E | |
| SCHEMBL10706756 | 0.71 | ADRB2 (0.65) | CYP1A2CYP2C9CYP2C19CYP19A1KDM4E | |
| SCHEMBL16582005 | 0.70 | MEN1 (0.57) | CYP1A2CYP2C9CYP2C19CYP19A1PDE5A |
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-107922345-A | Arylsulfonamide compounds and its therapeutical uses as carbonic anhydrase inhibitor | 圣诺康生命科学公司 | 2018-04-17 | — | — | CN | claimed |
| CN-107922345-A | Arylsulfonamide compounds and its therapeutical uses as carbonic anhydrase inhibitor | 圣诺康生命科学公司 | 2018-04-17 | — | — | CN | disclosed |