Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 8/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAF1 | P04049 | 1/20 | 0.46 |
| ▸ | BRAF | P15056 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8219325 | 0.92 | SMO (0.71) | SMOMAPTALDH1A1KDM4ELMNA | |
| SCHEMBL11911336 | 0.83 | MAPT (0.61) | SMOMAPTALDH1A1KDM4ELMNA | |
| SCHEMBL8228252 | 0.80 | SMO (0.56) | SMOALDH1A1MEN1KMT2APKM | |
| SCHEMBL7782126 | 0.78 | MAPK14 (0.56) | SMOMAPTALDH1A1KDM4EMEN1 | |
| SCHEMBL8219590 | 0.76 | SMO (0.79) | SMOMAPTMEN1KMT2AGAA | |
| SCHEMBL8224616 | 0.74 | SMO (0.65) | SMOALDH1A1MEN1KMT2APKM | |
| SCHEMBL8211785 | 0.74 | SMO (0.65) | SMOMAPTALDH1A1MEN1KMT2A | |
| SCHEMBL8211905 | 0.74 | MAPT (0.68) | SMOMAPTALDH1A1KDM4ELMNA | |
| SCHEMBL8224661 | 0.74 | SMO (0.64) | SMOALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL8221492 | 0.74 | SMO (0.64) | SMOALDH1A1MEN1KMT2APOLB |
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-2456754-A1 | ACYL GUANIDINE DERIVATIVES MODULATING THE HEDGEHOG PROTEIN SIGNALING PATHWAY | Universite De Strasbourg (FR) | 2012-05-30 | — | — | EP | disclosed |
| WO-2011010013-A1 | ACYL GUANIDINE DERIVATIVES MODULATING THE HEDGEHOG PROTEIN SIGNALING PATHWAY | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2011-01-27 | — | — | WO | disclosed |