Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21120260 | 0.83 | CYP2D6 (0.36) | HTR2CHTR2BHTR2AEPHX2TAAR1 | |
| SCHEMBL19776019 | 0.81 | AR (0.38) | HTR2CHTR2BEPHX2TAAR1SLC6A2 | |
| SCHEMBL30684831 | 0.78 | NOTUM (0.40) | HTR2CHTR2BHTR2AEPHX2TAAR1 | |
| SCHEMBL3874122 | 0.78 | NOTUM (0.40) | HTR2CHTR2BHTR2AEPHX2TAAR1 | |
| Hydrochloric Acid SCHEMBL28637723 | 0.76 | NOTUM (0.39) | HTR2CHTR2BHTR2AEPHX2TAAR1 | |
| SCHEMBL11337766 | 0.75 | PNMT (0.46) | HTR2CHTR2BHTR2A | |
| SCHEMBL329629 | 0.71 | PNMT (0.56) | HTR2CHTR2BHTR2A | |
| Hydrochloric Acid SCHEMBL2259424 | 0.70 | PNMT (0.54) | HTR2CHTR2BHTR2A | |
| SCHEMBL8675324 | 0.68 | HTR2C (0.41) | HTR2CHTR2BHTR2AEPHX2CHRNB2 | |
| SCHEMBL798791 | 0.68 | CD44 (0.56) | HTR2CHTR2BHTR2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3233862-B1 | IMIDAZOPYRIDAZINE DERIVATIVES AS PI3KBETA INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2019-07-03 | — | — | EP | disclosed |