Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 15/20 | 0.50 |
| ▸ | CA2 | P00918 | 15/20 | 0.50 |
| ▸ | FNTA | P49354 | 2/20 | 0.43 |
| ▸ | FNTB | P49356 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 14/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA3 | P07451 | 4/20 | 0.39 |
| ▸ | CA4 | P22748 | 4/20 | 0.39 |
| ▸ | CA6 | P23280 | 4/20 | 0.39 |
| ▸ | CA5A | P35218 | 4/20 | 0.39 |
| ▸ | CA7 | P43166 | 4/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3342900 | 0.92 | — | — | |
| SCHEMBL3640927 | 0.87 | CA2 (0.50) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL1712192 | 0.84 | FNTA (0.53) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL27576132 | 0.84 | FNTA (0.53) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL721222 | 0.84 | FNTA (0.53) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL5788200 | 0.84 | FNTA (0.53) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL17456416 | 0.84 | FNTA (0.48) | CA1CA2FNTAFNTBCA9 | |
| SCHEMBL5081931 | 0.83 | CA1 (0.48) | CA1CA2CA9KDM4EUSP2 | |
| SCHEMBL11155659 | 0.81 | — | — | |
| SCHEMBL17456410 | 0.81 | FNTA (0.52) | CA1CA2FNTAFNTBCA9 |
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-4145264-A | AROMATIC O-DICARBOXYLIC ACID NITRILES ELECTROLYZED IN AN ORGANIC LIQUID WITH AN ALKALINE ACTIVATOR | BASF AKTIENGESELLSCHAFT (DE) | 1979-03-20 | — | — | US | disclosed |