Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY6 | Q15077 | 3/20 | 0.50 |
| ▸ | MIF | P14174 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LTA | P01374 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.33 |
| ▸ | RAD51 | Q06609 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | RAD1 | O60671 | 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 | |
|---|---|---|---|---|
| SCHEMBL3914324 | 0.80 | CYP3A4 (0.48) | P2RY6CA1CA2CYP3A4TDP1 | |
| Bitoscanate SCHEMBL157128 | 0.80 | MIF (0.72) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL941550 | 0.78 | MIF (0.56) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL9857139 | 0.78 | MIF (0.47) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL40681 | 0.74 | MIF (0.53) | P2RY6MIFCA1CA2KDM4E | |
| SCHEMBL1548531 | 0.72 | MIF (0.62) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL3823434 | 0.71 | MIF (0.67) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL5501717 | 0.71 | P2RY6 (0.48) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL1588318 | 0.71 | P2RY6 (0.48) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL10711773 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0452858-A2 | Metal complexes of acid adducts to dioxime ligands useful in labelling proteins and other amine-containing compounds | BRACCO INTERNATIONAL B.V. (NL) | 1991-10-23 | — | — | EP | claimed |