Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 12/20 | 0.53 |
| ▸ | PFKFB1 | P16118 | 11/20 | 0.53 |
| ▸ | PFKFB2 | O60825 | 10/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.49 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL23373329 | 1.00 | PFKFB3 (0.53) | PFKFB3PFKFB1PFKFB2ALDH1A1LMNA | |
| SCHEMBL23373326 | 0.93 | PFKFB3 (0.58) | PFKFB3PFKFB1PFKFB2ALDH1A1SCN3A | |
| SCHEMBL85092 | 0.92 | RAB9A (0.56) | ALDH1A1SCN3ASCN9ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL76439 | 0.90 | SCN3A (0.57) | ALDH1A1SCN3ASCN9ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL76440 | 0.90 | SCN3A (0.57) | ALDH1A1SCN3ASCN9ANPC1RAB9A | |
| SCHEMBL23373375 | 0.88 | PFKFB3 (0.55) | PFKFB3PFKFB1PFKFB2 | |
| SCHEMBL23373378 | 0.88 | PFKFB3 (0.61) | PFKFB3PFKFB1PFKFB2SCN3ASCN9A | |
| SCHEMBL2172458 | 0.87 | HTR2C (0.55) | PFKFB3PFKFB1PFKFB2ALDH1A1SCN3A | |
| SCHEMBL23373331 | 0.87 | PFKFB3 (0.56) | PFKFB3PFKFB1PFKFB2SCN3ASCN9A | |
| SCHEMBL23373327 | 0.86 | PFKFB3 (0.55) | PFKFB3PFKFB1PFKFB2SCN3ASCN9A |
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 |