Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20601783 | 0.72 | RORC (0.43) | HTR6LMNAALDH1A1HTTKMT2A | |
| SCHEMBL31585889 | 0.72 | RORC (0.43) | HTR6LMNAALDH1A1HTTKMT2A | |
| SCHEMBL22871302 | 0.72 | MAPT (0.42) | CYP2C9LMNAALDH1A1HTTGAA | |
| SCHEMBL17158192 | 0.72 | KMT2A (0.47) | NPC1LMNAALDH1A1KMT2AMAPT | |
| SCHEMBL8672389 | 0.71 | KCNN4 (0.60) | KCNN4KCNA3HTR6CYP2C19CYP2C9 | |
| SCHEMBL20601657 | 0.70 | MAPT (0.43) | LMNAALDH1A1HTTKMT2AMAPT | |
| SCHEMBL769030 | 0.70 | TP53 (0.44) | OXTRKCNN4KCNA3HTR6CYP2C19 | |
| SCHEMBL31585948 | 0.70 | MAPT (0.43) | LMNAALDH1A1HTTKMT2AMAPT | |
| SCHEMBL17158300 | 0.70 | MEN1 (0.48) | CYP2C19KMT2AMAPTMEN1 | |
| SCHEMBL6369328 | 0.69 | CYP3A4 (0.62) | KCNN4KCNA3CYP2C19CYP2C9CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000212165-A | NEW 4,4-DIFLUOROBENZOAZEPINE KETAL DERIVATIVE, AND PRODUCTION OF 4,4-DIFLUOROBENZOAZEPIN-5-ONE DERIVATIVE THROUGH THE SAME | F-TECH INC | 2000-08-02 | — | — | JP | disclosed |