Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.74 |
| ▸ | CA1 | P00915 | 7/20 | 0.74 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.52 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 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 | |
|---|---|---|---|---|
| SCHEMBL6567680 | 0.83 | CA1 (0.51) | CA2CA1ANO1L3MBTL1HPGD | |
| SCHEMBL22219971 | 0.77 | CA2 (0.69) | CA2CA1HSD17B2ANO1SIGMAR1 | |
| SCHEMBL5988460 | 0.77 | CA2 (0.69) | CA2CA1HSD17B2ANO1SIGMAR1 | |
| SCHEMBL4358325 | 0.75 | POLB (0.60) | CA2CA1HPGD | |
| SCHEMBL31117181 | 0.74 | POLB (0.60) | L3MBTL1HPGDKDM4E | |
| SCHEMBL10001174 | 0.74 | CA2 (0.65) | CA2CA1HSD17B2ANO1HPGD | |
| SCHEMBL6567265 | 0.74 | CA1 (0.47) | CA2CA1ANO1L3MBTL1HPGD | |
| SCHEMBL4342228 | 0.72 | CA2 (0.42) | CA2CA1ANO1HPGD | |
| SCHEMBL7148985 | 0.72 | CA2 (0.70) | CA2CA1HSD17B2HPGDSIGMAR1 | |
| SCHEMBL2003361 | 0.71 | ALDH1A1 (0.66) | CA2CA1HSD17B2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |