Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.33 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.33 |
| ▸ | GSK3A | P49840 | 2/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.33 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3326167 | 0.72 | CYP1A2 (0.43) | NR1H2NR1H3HTR2ACALM1ALDH1A1 | |
| SCHEMBL558333 | 0.69 | FFAR1 (0.32) | HTR2AALDH1A1GAANPC1RAB9A | |
| SCHEMBL695629 | 0.66 | CALM1 (0.41) | NR1H2NR1H3CALM1ALDH1A1MAPT | |
| SCHEMBL3002 | 0.62 | ALDH1A1 (0.41) | ALDH1A1MEN1MAPTKMT2AKDM4E | |
| SCHEMBL11901755 | 0.62 | CALM1 (0.41) | HTR2CHTR2BHTR2ACALM1ALDH1A1 | |
| SCHEMBL4120558 | 0.62 | CALM1 (0.41) | HTR2CHTR2BHTR2ACALM1ALDH1A1 | |
| SCHEMBL2820256 | 0.61 | CALM1 (0.73) | HTR2ACALM1ALDH1A1MAPTKDM4E | |
| SCHEMBL8106395 | 0.61 | CALM1 (0.39) | HTR2CHTR2BHTR2ACALM1ALDH1A1 | |
| SCHEMBL2353932 | 0.61 | METAP2 (0.47) | NR1H2NR1H3ALDH1A1KDM4EGAA | |
| SCHEMBL15104760 | 0.61 | CALM1 (0.55) | CALM1ALDH1A1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999035132-A1 | HETEROCYCLIC COMPOUNDS | GLAXO GROUP LIMITED (GB) | 1999-07-15 | — | — | WO | claimed |
| WO-1999035132-A1 | HETEROCYCLIC COMPOUNDS | GLAXO GROUP LIMITED (GB) | 1999-07-15 | — | — | WO | disclosed |