Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.48 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL28454653 | 0.86 | HPGD (0.49) | CYP1A2SMN1; SMN2ADORA3HPGDTP53 | |
| SCHEMBL11767746 | 0.80 | SMN1; SMN2 (0.57) | CYP1A2SMN1; SMN2ADORA3HPGDTP53 | |
| SCHEMBL11769430 | 0.80 | CYP1A2 (0.51) | CYP1A2SMN1; SMN2FGFR1FGFR4ADORA3 | |
| SCHEMBL28443180 | 0.80 | SMN1; SMN2 (0.56) | CYP1A2SMN1; SMN2HPGDALDH1A1TSHR | |
| SCHEMBL28450982 | 0.80 | SMN1; SMN2 (0.44) | CYP1A2SMN1; SMN2TP53ALDH1A1TSHR | |
| SCHEMBL11772597 | 0.78 | CYP1A2 (0.52) | CYP1A2SMN1; SMN2ADORA3HPGDALDH1A1 | |
| SCHEMBL11770744 | 0.78 | CYP1A2 (0.48) | CYP1A2SMN1; SMN2ADORA3HPGDALDH1A1 | |
| SCHEMBL11770739 | 0.77 | CYP1A2 (0.50) | CYP1A2SMN1; SMN2FGFR1FGFR4HPGD | |
| SCHEMBL28447631 | 0.73 | GRM2 (0.56) | ADORA3TP53ALDH1A1TSHRKMT2A | |
| SCHEMBL11769900 | 0.73 | CYP1A2 (0.43) | CYP1A2SMN1; SMN2ADORA3HPGDALDH1A1 |
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-111606928-A | Azacyclodiketone compound and preparation method thereof | 维清生物科技(上海)有限公司 | 2020-09-01 | — | — | CN | disclosed |