Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.61 |
| ▸ | CA1 | P00915 | 2/20 | 0.61 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | BCR | P11274 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HPN | P05981 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29933298 | 1.00 | CA2 (0.61) | CA2CA1HSP90AA1ABL1ABCB1 | |
| SCHEMBL7650206 | 0.86 | CA2 (0.42) | CA2CA1HSP90AA1PTGS2PTGS1 | |
| SCHEMBL240515 | 0.83 | CA2 (0.80) | CA2CA1HSP90AA1PTGS2PTGS1 | |
| SCHEMBL29602570 | 0.83 | CA2 (0.80) | CA2CA1HSP90AA1PTGS2PTGS1 | |
| SCHEMBL7647539 | 0.80 | CA1 (0.59) | CA2CA1ABL1ABCB1BCR | |
| SCHEMBL7650252 | 0.80 | CA1 (0.42) | CA2CA1ABL1ABCB1BCR | |
| SCHEMBL7648531 | 0.80 | CA1 (0.42) | CA2CA1ABL1ABCB1BCR | |
| SCHEMBL4575808 | 0.79 | CA1 (0.62) | CA2CA1ABL1ABCB1BCR | |
| SCHEMBL7648280 | 0.78 | HSP90AA1 (0.56) | CA2CA1HSP90AA1CYP2C9CYP2C19 | |
| SCHEMBL29933377 | 0.78 | HSP90AA1 (0.56) | CA2CA1HSP90AA1CYP2C9CYP2C19 |
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-6486359-B1 | Catalyst comprising a complex of a metal of subgroup viii based on a phosphinite ligand, and a method for hydroformylation | BASF AKTIENGESELLSCHAFT (DE) | 2002-11-26 | — | — | US | disclosed |