Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.37 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.37 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL3706594 | 0.84 | KCNH2 (0.48) | PTGDR2KCNH2NR1I2CYP3A4SCN5A | |
| SCHEMBL3842623 | 0.83 | KMO (0.38) | PTGDR2SCN5A | |
| SCHEMBL5341238 | 0.81 | KMT2A (0.36) | PTGDR2NSD2NSD1NSD3LPAR5 | |
| SCHEMBL5927622 | 0.80 | KCNH2 (0.46) | PTGDR2MEN1GAAKMT2ACNR2 | |
| SCHEMBL3871757 | 0.78 | KMT2A (0.37) | PTGDR2MEN1GAAKMT2AKDM4E | |
| SCHEMBL14253860 | 0.73 | KCNH2 (0.47) | PTGDR2CNR2KCNH2NR1I2CYP3A4 | |
| SCHEMBL3907051 | 0.73 | KCNH2 (0.47) | PTGDR2CNR2KCNH2NR1I2CYP3A4 | |
| SCHEMBL3857111 | 0.72 | KCNH2 (0.47) | PTGDR2BRD4KCNH2NR1I2CYP3A4 | |
| SCHEMBL5927627 | 0.69 | KDM4E (0.40) | MEN1GAAKMT2AKDM4ECYP3A4 | |
| SCHEMBL2637665 | 0.68 | NR1I2 (0.64) | KCNH2NR1I2CYP3A4SCN5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007033175-A1 | INDOLOBENZAZEPINE HCV NS5B INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-03-22 | — | — | WO | disclosed |