Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | SNCA | P37840 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL845051 | 0.81 | NPSR1 (0.40) | CNR1ALDH1A1TAAR1KDM4ENPSR1 | |
| SCHEMBL27883300 | 0.76 | KDM4E (0.33) | ALDH1A1KDM4ENPSR1SMN1; SMN2MEN1 | |
| SCHEMBL1728325 | 0.75 | ALDH1A1 (0.41) | CNR1ALDH1A1TAAR1KDM4ENPSR1 | |
| SCHEMBL7307 | 0.71 | ALDH1A1 (0.40) | CNR1ALDH1A1TAAR1KDM4ENPSR1 | |
| SCHEMBL11512 | 0.69 | GAA (0.35) | MEN1KMT2AL3MBTL1CYP2C9 | |
| SCHEMBL5138 | 0.67 | MAPT (0.32) | KDM4ENPSR1 | |
| SCHEMBL27611366 | 0.66 | HPGD (0.49) | CNR1ALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8614 | 0.66 | DRD4 (0.45) | ALDH1A1TAAR1NPSR1L3MBTL1CYP1A2 | |
| SCHEMBL5526 | 0.64 | ALDH1A1 (0.55) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL19212131 | 0.64 | HDAC1 (0.36) | TAAR1SMN1; SMN2KMT2ARAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2432784-A1 | FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS | UCB Pharma, S.A. (BE) | 2012-03-28 | — | — | EP | disclosed |
| WO-2011058109-A1 | FUSED BICYCLIC PYRROLE AND IMIDAZOLE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2011-05-19 | — | — | WO | disclosed |
| WO-2010133836-A1 | FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2010-11-25 | — | — | WO | disclosed |