Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Propylthiouracil. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPO known ✓ | P07202 | 1/20 | 0.59 |
| ▸ | LPO | P22079 | 2/20 | 0.59 |
| ▸ | MPO | P05164 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYB5R3 | P00387 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 10/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Methylthiouracil SCHEMBL13723723 | 0.85 | SMN1; SMN2 (0.50) | LPOMPOTPOTSHRCYP2C19 | |
| SCHEMBL954608 | 0.82 | CRBN (0.46) | GPR84CRBN | |
| Propylthiouracil SCHEMBL5493716 | 0.77 | LPO (1.00) | LPOMPOTPOTSHRCYP2C19 | |
| Propylthiouracil SCHEMBL41239 | 0.77 | LPO (1.00) | LPOMPOTPOTSHRCYP2C19 | |
| Thiourea SCHEMBL29139741 | 0.77 | CRBN (0.39) | MAPTALDH1A1CRBN | |
| Propylthiouracil SCHEMBL27995248 | 0.76 | LPO (0.96) | LPOMPOTPOTSHRCYP2C19 | |
| SCHEMBL4347792 | 0.72 | CRBN (0.47) | ALDH1A1CRBN | |
| SCHEMBL16671886 | 0.72 | GPR84 (0.43) | CYP2C19SMN1; SMN2GPR84CRBN | |
| SCHEMBL8407853 | 0.71 | KMT2A (0.90) | LPOMPOTPOTSHRCYP2C19 | |
| SCHEMBL8653846 | 0.71 | GPR84 (0.46) | CYP2C19GPR84CRBN |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1919257-B | Application of litsea coreana ethanol extractive in the preparation of medicine for preventing and treating alcohol hepatopathy | UNIV ANHUI MEDICAL | 2010-05-12 | — | — | CN | disclosed |
| CN-100528179-C | Application of chrysanthemum indicum extract in the preparation of medicine for preventing and curing alcoholic liver disease | UNIV ANHUI MEDICAL (CN) | 2009-08-19 | — | — | CN | disclosed |
| CN-101112407-A | Application of chrysanthemum indicum extract in the preparation of medicine for preventing and curing alcoholic liver disease | UNIV ANHUI MEDICAL (CN) | 2008-01-30 | — | — | CN | disclosed |
| WO-2007062198-A1 | METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY | ADVANCED CELL TECHNOLOGY, INC. (US) | 2007-05-31 | — | — | WO | disclosed |
| CN-1919257-A | Application of litsea coreana ethanol extractive in the preparation of medicine for preventing and treating alcohol hepatopathy | UNIV ANHUI MEDICAL (CN) | 2007-02-28 | — | — | CN | disclosed |