Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8034737 | 0.82 | CA2 (0.61) | CA2CA1CA9CA5AGAA | |
| SCHEMBL8668287 | 0.80 | CA2 (0.46) | CA2CA1CA9CA5AGAA | |
| SCHEMBL28261715 | 0.80 | CA2 (0.41) | CA2CA1CA9CA5AGAA | |
| SCHEMBL6535568 | 0.79 | CA1 (0.66) | CA2CA1CA9CA5AGAA | |
| SCHEMBL5930965 | 0.79 | CA2 (0.45) | CA2CA1CA9CA5AGAA | |
| SCHEMBL8507050 | 0.76 | CDK1 (0.56) | GAAKDM4EALDH1A1MAPTGLA | |
| SCHEMBL27572343 | 0.75 | CDK1 (0.38) | CA2CA1CA9CA5AGAA | |
| SCHEMBL7426414 | 0.73 | KDM4E (0.46) | CA2CA1CA9GAAKDM4E | |
| SCHEMBL6012073 | 0.73 | CA2 (0.40) | CA2CA1CA9CA5AGAA | |
| SCHEMBL9143218 | 0.73 | CA2 (0.61) | CA2CA1CA9CA5AGAA |
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-6147248-A | 4-jod-2[N-(N-alkyl-aminocarbonyl)-aminosulfonyl]-benzoic acid methyl ester and derivatived thereof and method for their production | HOECHST SCHERING AGREVO GMBH (DE) | 2000-11-14 | — | — | US | disclosed |