Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 3/20 | 0.48 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | PLEC | Q15149 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5685122 | 0.95 | TSHR (0.47) | CYP3A4TSHRRECQLIDO1PGK1 | |
| SCHEMBL26429542 | 0.89 | CYP3A4 (0.52) | CYP3A4TSHRRECQLIDO1PGK1 | |
| SCHEMBL26429718 | 0.83 | HMGCR (0.47) | CYP3A4TSHRRECQLIDO1PGK1 | |
| SCHEMBL23714520 | 0.80 | CYP3A4 (0.59) | CYP3A4TSHRRECQLIDO1PGK1 | |
| SCHEMBL28278780 | 0.79 | CYP3A4 (0.62) | CYP3A4TSHRRECQLIDO1KDM4E | |
| SCHEMBL1368372 | 0.77 | IDO1 (0.59) | CYP3A4TSHRRECQLIDO1KDM4E | |
| SCHEMBL30086871 | 0.77 | CYP3A4 (0.50) | CYP3A4TSHRRECQLIDO1GAA | |
| SCHEMBL1259060 | 0.77 | CYP3A4 (0.50) | CYP3A4TSHRRECQLIDO1GAA | |
| SCHEMBL11211267 | 0.77 | CYP3A4 (0.50) | CYP3A4TSHRRECQLIDO1KDM4E | |
| SCHEMBL27534388 | 0.75 | IDO1 (0.47) | CYP3A4TSHRRECQLIDO1KDM4E |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0246112-B1 | PREPARATION OF DIAMINO- AND DIALKYLAMINOBENZENEDIOLS | THE DOW CHEMICAL COMPANY (US) | 1991-06-12 | — | — | EP | disclosed |
| EP-0324847-A4 | PREPARATION OF BIS (AMINE-CONTAINING) BENZENEDIOLS | — | 1991-03-20 | — | — | EP | disclosed |
| EP-0324847-A1 | PREPARATION OF BIS (AMINE-CONTAINING) BENZENEDIOLS | THE DOW CHEMICAL COMPANY (US) | 1989-07-26 | — | — | EP | disclosed |
| US-4806688-A | Preparation of diamino- and dialkylaminobenzenediols | THE DOW CHEMICAL COMPANY (US) | 1989-02-21 | — | — | US | disclosed |
| WO-1989000556-A1 | PREPARATION OF BIS (AMINE-CONTAINING) BENZENEDIOLS | THE DOW CHEMICAL COMPANY (US) | 1989-01-26 | — | — | WO | disclosed |
| EP-0246112-A1 | Preparation of diamino- and dialkylaminobenzenediols | THE DOW CHEMICAL COMPANY (US) | 1987-11-19 | — | — | EP | disclosed |
| WO-1987006930-A1 | PREPARATION OF DIAMINO- AND DIALKYLAMINOBENZENEDIOLS | THE DOW CHEMICAL COMPANY (US) | 1987-11-19 | — | — | WO | disclosed |