Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 7/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL5677813 | 1.00 | BRD4 (0.38) | BRD4SLC22A12KMT2AGAAALDH1A1 | |
| SCHEMBL5679757 | 0.89 | AAK1 (0.41) | SLC22A12ALDH1A1MAPTCTSK | |
| SCHEMBL5679751 | 0.89 | AAK1 (0.41) | SLC22A12ALDH1A1MAPTCTSK | |
| SCHEMBL5678090 | 0.88 | BRD4 (0.37) | BRD4SLC22A12KMT2AALDH1A1MAPT | |
| SCHEMBL5678084 | 0.88 | BRD4 (0.37) | BRD4SLC22A12KMT2AALDH1A1MAPT | |
| SCHEMBL5679817 | 0.86 | PPARG (0.36) | SLC22A12 | |
| SCHEMBL5679829 | 0.86 | PPARG (0.36) | SLC22A12 | |
| SCHEMBL5679666 | 0.75 | DYRK1A (0.46) | BRD4SLC22A12KMT2AALDH1A1KDM4E | |
| SCHEMBL5679657 | 0.75 | DYRK1A (0.46) | BRD4SLC22A12KMT2AALDH1A1KDM4E | |
| SCHEMBL5678047 | 0.73 | GLS (0.43) | BRD4KMT2AGAAALDH1A1KDM4E |
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-1129078-B1 | INDAZOLE DERIVATIVES WITH 5-HT2 RECEPTOR ACTIVITY | VERNALIS RES LTD (GB) | 2006-03-15 | — | — | EP | disclosed |
| US-6552062-B1 | For therapy of central nervous system disorders; damage to the central nervous system; cardiovascular disorders; gastrointestinal disorders; diabetes insipidus, and sleep apnea, and obesity | VERNALIS RESEARCH LIMITED (GB) | 2003-04-22 | — | — | US | disclosed |