Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 12/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP7 | P09237 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2170387 | 0.88 | ALDH1A1 (0.47) | HRH3KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL2171604 | 0.83 | SCN9A (0.44) | KDM4EALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL2171837 | 0.83 | ALDH1A1 (0.52) | KDM4EALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL2169794 | 0.83 | ALDH1A1 (0.45) | KDM4EALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL2170422 | 0.80 | ALDH1A1 (0.39) | KDM4EALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL2172986 | 0.79 | ALDH1A1 (0.40) | KDM4EALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL2170251 | 0.76 | ALDH1A1 (0.57) | KDM4EALDH1A1MEN1KMT2AL3MBTL1 | |
| SCHEMBL2173714 | 0.76 | SCN9A (0.45) | HRH3KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL2350975 | 0.74 | TRPV1 (0.50) | ALDH1A1 | |
| SCHEMBL2173707 | 0.74 | MEN1 (0.50) | HRH3KDM4EALDH1A1MEN1KMT2A |
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-2346821-A1 | SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS | Exelixis, Inc. (US) | 2011-07-27 | — | — | EP | disclosed |