Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.43 |
| ▸ | APLNR | P35414 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | FLT4 | P35916 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL8726603 | 0.82 | CES2 (0.49) | SMN1; SMN2GAAHTT | |
| SCHEMBL19914018 | 0.81 | DGAT1 (0.44) | DGAT1APLNRLMNANPC1RAB9A | |
| SCHEMBL27635781 | 0.76 | APLNR (0.47) | DGAT1APLNRLMNANPC1RAB9A | |
| SCHEMBL684386 | 0.76 | DGAT1 (0.44) | DGAT1APLNRALDH1A1L3MBTL1KDM4E | |
| SCHEMBL27747528 | 0.75 | APLNR (0.48) | DGAT1APLNRLMNANPC1RAB9A | |
| SCHEMBL9515508 | 0.75 | APLNR (0.48) | DGAT1APLNRLMNANPC1RAB9A | |
| SCHEMBL9560863 | 0.74 | CES2 (0.46) | LMNAALDH1A1KMT2AGAAMEN1 | |
| SCHEMBL1679175 | 0.74 | PTGS1 (0.51) | DGAT1APLNRKMT2AMEN1FPR2 | |
| SCHEMBL15053941 | 0.73 | ACACB (0.47) | DGAT1APLNRL3MBTL1KDM4EACACB | |
| SCHEMBL18839300 | 0.72 | DGAT1 (0.51) | DGAT1APLNRLMNANPC1RAB9A |
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-2403846-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. Hoffmann-La Roche AG (CH) | 2012-01-11 | — | — | EP | disclosed |
| WO-2010100070-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-10 | — | — | WO | disclosed |