Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14003557 | 0.79 | MAPT (0.39) | CYP19A1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL23918368 | 0.77 | RECQL (0.41) | ALDH1A1KDM4EMAPTKMT2ARECQL | |
| SCHEMBL30912518 | 0.67 | ALDH1A1 (0.42) | CYP19A1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL30912507 | 0.67 | ALDH1A1 (0.42) | CYP19A1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL25416662 | 0.67 | ALDH1A1 (0.42) | CYP19A1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL13478303 | 0.67 | L3MBTL1 (0.47) | CYP19A1ALDH1A1KDM4EMAPTGAA | |
| SCHEMBL11090155 | 0.66 | CYP19A1 (0.50) | CYP19A1 | |
| SCHEMBL10499193 | 0.64 | CYP19A1 (0.44) | CYP19A1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL10556483 | 0.64 | GAA (0.33) | ALDH1A1KMT2AMEN1GAASMN1; SMN2 | |
| SCHEMBL9123388 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6034099-A | Method for inhibiting neoplastic lesions by administering 4-(arylmethylene)- 2, 3- dihydro-pyrazol-3-ones | CELL PATHWAYS, INC. (US) | 2000-03-07 | — | — | US | disclosed |