Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 6/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.45 |
| ▸ | PPARG | P37231 | 7/20 | 0.45 |
| ▸ | PPARD | Q03181 | 7/20 | 0.45 |
| ▸ | PPARA | Q07869 | 7/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | TLR2 | O60603 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | FABP4 | P15090 | 2/20 | 0.45 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.45 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 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 | |
|---|---|---|---|---|
| SCHEMBL2724297 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL10456449 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL5475927 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL2275962 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL1289856 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL7144901 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL2599608 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL1496134 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL6856226 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 | |
| SCHEMBL301601 | 0.85 | TSHR (0.67) | ALDH1A1TSHRLMNANFKB1PMP22 |
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-1581535-A1 | PYRROLOPYRIDAZINE DERIVATIVES | Astellas Pharma Inc. (JP) | 2005-10-05 | — | — | EP | disclosed |
| WO-2004063197-A1 | PYRROLOPYRIDAZINE DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-07-29 | — | — | WO | disclosed |