Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2776281 | 0.98 | TSHR (0.36) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL25237284 | 0.82 | MEN1 (0.39) | ALDH1A1TSHRMEN1KMT2A | |
| Acetic Acid SCHEMBL28158415 | 0.80 | THRB (0.48) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL8940602 | 0.79 | ALDH1A1 (0.35) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL33780 | 0.79 | THRB (0.52) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL11127704 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Methacrylic Acid SCHEMBL9453881 | 0.79 | THRB (0.47) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Methacrylic Acid SCHEMBL10424224 | 0.79 | THRB (0.47) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Potassium Ion SCHEMBL752380 | 0.78 | ALDH1A1 (0.34) | ALDH1A1TSHRMEN1KMT2A | |
| Carbamic Acid SCHEMBL28329175 | 0.77 | THRB (0.46) | ALDH1A1TSHRMEN1KMT2ATHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1756065-A1 | ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005115991-A1 | ANTI-CYTOKINE HETEROCYCLIC COMPOUNDS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2005-12-08 | — | — | WO | disclosed |