Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL4780332 | 0.90 | CHRM4 (0.38) | NOTUMKDM4EALDH1A1KMT2ATDP1 | |
| SCHEMBL4321609 | 0.86 | GRM5 (0.42) | ALDH1A1KMT2ADRD2DRD3CHRM4 | |
| SCHEMBL4780326 | 0.86 | CHRM4 (0.40) | KDM4EALDH1A1DRD2DRD3SMN1; SMN2 | |
| SCHEMBL4774390 | 0.85 | KDM4E (0.40) | KDM4EALDH1A1KMT2ATDP1DRD2 | |
| SCHEMBL4774338 | 0.85 | DRD2 (0.32) | KDM4EALDH1A1TDP1DRD2DRD3 | |
| SCHEMBL4779536 | 0.85 | DRD2 (0.32) | KDM4EALDH1A1TDP1DRD2DRD3 | |
| SCHEMBL4779787 | 0.84 | FFAR4 (0.38) | KMT2ALMNAPOLBMEN1 | |
| SCHEMBL4781178 | 0.84 | UBE2M (0.39) | ALDH1A1KMT2ALMNAPOLBSMN1; SMN2 | |
| SCHEMBL4776176 | 0.82 | FFAR4 (0.40) | KMT2AMEN1 | |
| SCHEMBL4781028 | 0.82 | KDM4E (0.43) | NOTUMKDM4EALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008010061-A2 | 3-AZABICYCLO [3.1.0] HEXANE VANILLOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION | GLENMARK PHARMACEUTICALS S.A. (US) | 2008-01-24 | — | — | WO | disclosed |