Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.68 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.64 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.64 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.64 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.64 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.64 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.64 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.64 |
| ▸ | KDR | P35968 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL30937969 | 1.00 | POLB (0.68) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL12186812 | 0.89 | POLB (0.62) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL15441493 | 0.88 | HDAC3 (0.61) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL29894470 | 0.86 | POLB (0.73) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL21565076 | 0.86 | POLB (0.73) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL15447115 | 0.85 | TDP1 (0.60) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL1753903 | 0.85 | TDP1 (0.79) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL12186783 | 0.84 | HDAC6 (0.74) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL28329638 | 0.84 | HTT (0.74) | POLBLMNAALDH1A1TDP1HTT | |
| SCHEMBL2599105 | 0.83 | LMNA (0.58) | POLBLMNAALDH1A1TDP1HTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117945998-A | Ortho-selective deuteration method for aromatic amide compounds | 浙大宁波理工学院 | 2024-04-30 | — | — | CN | disclosed |
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |