Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | TXNRD1 | Q16881 | 2/20 | 0.36 |
| ▸ | CCR6 | P51684 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.35 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10976593 | 0.85 | ALDH1A1 (0.37) | CYP1A2TSHRSMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL18299389 | 0.84 | ALDH1A1 (0.36) | CYP1A2TSHRSMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL18299235 | 0.84 | MAPT (0.44) | CYP1A2TSHRSMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL26103584 | 0.80 | PDGFRB (0.45) | TSHRSMN1; SMN2ALDH1A1TDP1MEN1 | |
| SCHEMBL26099615 | 0.80 | TSHR (0.48) | TSHRSMN1; SMN2ALDH1A1TDP1MEN1 | |
| SCHEMBL2540815 | 0.80 | ALDH1A1 (0.50) | TSHRSMN1; SMN2ALDH1A1FFAR4MEN1 | |
| SCHEMBL13807644 | 0.80 | MAPT (0.49) | TSHRSMN1; SMN2ALDH1A1FFAR4MEN1 | |
| SCHEMBL31714528 | 0.80 | ALDH1A1 (0.50) | TSHRSMN1; SMN2ALDH1A1FFAR4MEN1 | |
| SCHEMBL15189277 | 0.78 | FFAR4 (0.42) | CYP1A2FFAR4PTGS1PTGS2MAPT | |
| SCHEMBL9369652 | 0.77 | GPR35 (0.50) | CYP1A2SMN1; SMN2ALDH1A1TDP1GPR35 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3636643-A1 | NUCLEAR RECEPTOR MODULATORS (ROR) FOR THE TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES | AbbVie Inc. (US) | 2020-04-15 | — | — | EP | disclosed |