Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7540781 | 0.80 | MAPK1 (0.38) | TDP1ALDH1A1KDM4EPOLBGAA | |
| SCHEMBL7540187 | 0.80 | KDM4E (0.47) | TDP1ALDH1A1KDM4EL3MBTL1POLB | |
| SCHEMBL7543629 | 0.76 | KMT2A (0.37) | TDP1ALDH1A1KDM4EL3MBTL1POLB | |
| SCHEMBL7547973 | 0.70 | HTR2A (0.39) | ALDH1A1KDM4EMAPTMAPK1HTT | |
| SCHEMBL7546763 | 0.67 | GRIN2D (0.36) | ALDH1A1KDM4EPOLBMEN1KMT2A | |
| Nitrous Acid SCHEMBL7549271 | 0.66 | HTR2A (0.36) | KDM4EMAPTHTTPTGS2 | |
| SCHEMBL4652150 | 0.65 | TDP1 (0.58) | TDP1ALDH1A1L3MBTL1POLBHPGD | |
| Bromide SCHEMBL4650887 | 0.64 | TDP1 (0.57) | TDP1ALDH1A1L3MBTL1POLBHPGD | |
| SCHEMBL7007492 | 0.61 | ALDH1A1 (0.41) | TDP1ALDH1A1KDM4EL3MBTL1GLA | |
| SCHEMBL5763685 | 0.60 | NR1H4 (0.49) | TDP1ALDH1A1KDM4EL3MBTL1POLB |
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-0883599-B1 | AMINOTETRALIN DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF | ASTRAZENECA AB (SE) | 2002-06-05 | — | — | EP | disclosed |
| US-5807897-A | MUSCULAR DISORDERS | ZENECA LIMITED (GB) | 1998-09-15 | — | — | US | disclosed |