Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.46 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.46 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.41 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.41 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.41 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | BUB1 | O43683 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16653120 | 0.83 | TK1 (0.43) | BUB1 | |
| SCHEMBL5334520 | 0.81 | TYMP (0.45) | KDM4ECYP1A2GRIA1GRIA2GRIA4 | |
| SCHEMBL8235112 | 0.81 | SQOR (0.49) | ASAH1SQORGRIA1GRIA2GRIA4 | |
| SCHEMBL4156346 | 0.81 | TYMP (0.45) | KDM4ECYP1A2GRIA1GRIA2GRIA4 | |
| SCHEMBL11024545 | 0.79 | LMNA (0.61) | LMNASMN1; SMN2CYP3A4CYP2D6MAPK3 | |
| SCHEMBL7821308 | 0.79 | BUB1 (0.34) | SMN1; SMN2SQORKDM4EKMT2AMAPT | |
| SCHEMBL7834254 | 0.79 | THRB (0.34) | KDM4ECYP1A2GRIA1GRIA2GRIA3 | |
| SCHEMBL20438154 | 0.79 | BUB1 (0.38) | SMN1; SMN2KDM4EMAPTBUB1 | |
| SCHEMBL20445101 | 0.79 | BUB1 (0.38) | SMN1; SMN2KDM4EKMT2AMAPTBUB1 | |
| SCHEMBL10656588 | 0.76 | LMNA (0.52) | LMNASMN1; SMN2CYP3A4CYP2D6MAPK3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013178545-A1 | ACID CERAMIDASE INHIBITORS AND THEIR USE AS MEDICAMENTS | FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) | 2013-12-05 | — | — | WO | disclosed |
| CN-101443664-A | Mass tags for quantitative analyses | APPLERA CORP (US) | 2009-05-27 | — | — | CN | disclosed |