Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.59 |
| ▸ | HTR3B | O95264 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | HTR3A | P46098 | 2/20 | 0.59 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.59 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.59 |
| ▸ | HTR7 | P34969 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | HTR6 | P50406 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL3781498 | 0.80 | KDM4E (0.55) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| SCHEMBL14894663 | 0.79 | HRH3 (0.50) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| SCHEMBL16124972 | 0.78 | ALDH1A1 (0.39) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| SCHEMBL6918242 | 0.75 | KDM4E (0.81) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| SCHEMBL24265517 | 0.75 | ALOX5 (0.50) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL29574338 | 0.75 | ALOX5 (0.50) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL5795727 | 0.75 | HTR3E (0.58) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| Quipazine SCHEMBL322181 | 0.74 | KDM4E (1.00) | KDM4EALDH1A1CYP3A4HSD17B10HTR3E | |
| SCHEMBL27329251 | 0.74 | RAB9A (0.53) | KDM4EALDH1A1HSD17B10CYP1A2TDP1 | |
| SCHEMBL1161095 | 0.74 | PLD1 (0.56) | ALDH1A1CYP3A4HSD17B10CYP1A2USP2 |
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-2432784-A1 | FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS | UCB Pharma, S.A. (BE) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010133836-A1 | FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2010-11-25 | — | — | WO | disclosed |