Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.77 |
| ▸ | MIF | P14174 | 12/20 | 0.73 |
| ▸ | NPC1 | O15118 | 4/20 | 0.73 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.70 |
| ▸ | MEN1 | O00255 | 3/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.69 |
| ▸ | RAB9A | P51151 | 3/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.69 |
| ▸ | HPGD | P15428 | 3/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.69 |
| ▸ | GLA | P06280 | 2/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.69 |
| ▸ | GAA | P10253 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.69 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.64 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.64 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL2166723 | 0.87 | ESR2 (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL591688 | 0.84 | MIF (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL5940881 | 0.83 | MIF (0.73) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL28142014 | 0.83 | PTGS1 (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL30023180 | 0.82 | MIF (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL14549127 | 0.82 | ESR2 (0.82) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL7124793 | 0.82 | MIF (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL8934492 | 0.82 | ESR2 (0.82) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL1325165 | 0.82 | MIF (1.00) | ESR2MIFNPC1PTGS1MEN1 | |
| SCHEMBL980362 | 0.80 | MIF (0.80) | ESR2MIFNPC1PTGS1MEN1 |
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-2236508-B1 | Reactive Heterocycle-Substituted 7-Hydroxycoumarins and Their Conjugates | BECTON DICKINSON CO (US) | 2015-08-26 | — | — | EP | disclosed |