Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11965490 | 0.89 | CYP1A2 (0.58) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL14232126 | 0.83 | CYP2D6 (0.53) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL14926622 | 0.83 | CYP2D6 (0.53) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL9510200 | 0.80 | CYP1A2 (0.50) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL6393911 | 0.80 | CA12 (0.47) | L3MBTL1ALDH1A1SMN1; SMN2TSHRHTT | |
| SCHEMBL13313232 | 0.79 | ALDH1A1 (0.54) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL13313217 | 0.79 | DRD2 (0.53) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL8339774 | 0.78 | MAPT (0.52) | L3MBTL1KDM4ERAB9A | |
| SCHEMBL9114592 | 0.78 | CYP1A2 (0.63) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 | |
| SCHEMBL25280430 | 0.78 | DRD2 (0.45) | CYP1A2CYP2D6CYP2C19TDP1L3MBTL1 |
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-110167946-A | Sulfonamide compounds with TNAP inhibitory activity | 第一三共株式会社 | 2019-08-23 | — | — | CN | disclosed |