Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | TACR2 | P21452 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PRMT5 | O14744 | 4/20 | 0.46 |
| ▸ | WDR77 | Q9BQA1 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.45 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.45 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7397704 | 1.00 | CYP2C19 (0.53) | CYP2C19MEN1TSHRKMT2AHTT | |
| SCHEMBL7397707 | 1.00 | CYP2C19 (0.53) | CYP2C19MEN1TSHRKMT2AHTT | |
| SCHEMBL18828716 | 0.81 | KMT2A (0.77) | CYP2C19MEN1TSHRKMT2AHTT | |
| SCHEMBL7567852 | 0.81 | KDM4E (0.57) | MEN1TSHRKMT2AHTTTACR2 | |
| SCHEMBL7567857 | 0.81 | KDM4E (0.57) | MEN1TSHRKMT2AHTTTACR2 | |
| SCHEMBL7567853 | 0.81 | KDM4E (0.57) | MEN1TSHRKMT2AHTTTACR2 | |
| SCHEMBL5913859 | 0.81 | EPHX1 (0.52) | KMT2AHTTTACR2ALDH1A1SLC6A4 | |
| SCHEMBL367115 | 0.81 | EPHX1 (0.52) | KMT2AHTTTACR2ALDH1A1SLC6A4 | |
| SCHEMBL19257998 | 0.81 | EPHX1 (0.52) | KMT2AHTTTACR2ALDH1A1SLC6A4 | |
| Hydrochloric Acid SCHEMBL6007905 | 0.79 | EPHX1 (0.50) | KMT2AHTTTACR2ALDH1A1SLC6A4 |
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-1997046553-A1 | THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1997-12-11 | — | — | WO | disclosed |