Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29699825 | 1.00 | CYP19A1 (0.53) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL29699784 | 0.86 | CYP19A1 (0.57) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL29700069 | 0.85 | PTGER1 (0.51) | CYP19A1PTGDR2KMT2AMEN1PTGER1 | |
| SCHEMBL16347172 | 0.83 | CYP19A1 (0.54) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL29699923 | 0.82 | CYP19A1 (0.64) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2LMNA | |
| SCHEMBL16347525 | 0.81 | CYP19A1 (0.53) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL16347297 | 0.81 | CYP19A1 (0.48) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL4501553 | 0.80 | ALDH1A1 (0.51) | KMT2AMEN1LMNAPOLBKDM4E | |
| SCHEMBL29699794 | 0.77 | HPGD (0.53) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD | |
| SCHEMBL15498678 | 0.76 | CYP19A1 (0.56) | CYP19A1L3MBTL1PTGDR2SMN1; SMN2HPGD |
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-114685371-A | Pyrazole carboxamide derivatives, their preparation and use | 四川大学 | 2022-07-01 | — | — | CN | disclosed |