Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP4A | P20648 | 2/20 | 0.51 |
| ▸ | ATP4B | P51164 | 2/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 5/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | CASP2 | P42575 | 1/20 | 0.40 |
| ▸ | RHOA | P61586 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16404152 | 0.89 | ATP4A (0.54) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL13175467 | 0.88 | AKR1C3 (0.51) | ATP4AATP4BAKR1C3ALDH1A1NPC1 | |
| SCHEMBL16404080 | 0.88 | ATP4A (0.50) | ATP4AATP4BAKR1C3ALDH1A1NPC1 | |
| SCHEMBL16404065 | 0.85 | ATP4A (0.64) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL14318291 | 0.85 | ATP4A (0.67) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL14318276 | 0.84 | ATP4A (0.69) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL16404111 | 0.80 | ATP4A (0.46) | ATP4AATP4BAKR1C3ALDH1A1NPC1 | |
| SCHEMBL16404112 | 0.80 | ATP4A (0.53) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL14318279 | 0.78 | NPC1 (0.57) | ATP4AATP4BALDH1A1NPC1RAB9A | |
| SCHEMBL16404143 | 0.78 | ATP4A (0.53) | ATP4AATP4BALDH1A1NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8937065-B2 | Compositions and methods for modulating a kinase | CLEVEXEL PHARMA (FR) | 2015-01-20 | — | — | US | disclosed |
| WO-2012172438-A9 | COMPOSITIONS AND METHODS FOR MODULATING A KINASE | DYNAMIX PHARMACEUTICALS LTD. (IL) | 2013-02-07 | — | — | WO | disclosed |
| WO-2012172438-A2 | COMPOSITIONS AND METHODS FOR MODULATING A KINASE | DYNAMIX PHARMACEUTICALS LTD. (IL) | 2012-12-20 | — | — | WO | disclosed |