Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 3/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL10217252 | 0.81 | PIK3CA (0.38) | PIK3CAPIK3CBPIK3CGMAPTKDM4E | |
| SCHEMBL10215147 | 0.70 | HTR2A (0.39) | PIK3CAPIK3CBPIK3CGHTR2AHTR2C | |
| SCHEMBL10173672 | 0.69 | MAPT (0.36) | PIK3CAPIK3CBPIK3CGMAPTMEN1 | |
| SCHEMBL17613183 | 0.65 | PIK3CA (0.39) | PIK3CAPIK3CBPIK3CGMAPTMEN1 | |
| SCHEMBL10173675 | 0.64 | PIK3CA (0.38) | PIK3CAPIK3CBPIK3CGMAPTKDM4E | |
| SCHEMBL9169246 | 0.60 | MAOB (0.38) | HTR2AHTR2CMAP3K14 | |
| SCHEMBL8980735 | 0.59 | DPP4 (0.39) | KDM4EMAP3K14 | |
| SCHEMBL14764759 | 0.59 | PIK3CA (0.37) | PIK3CAPIK3CBPIK3CGPIK3CD | |
| SCHEMBL14765030 | 0.57 | PIK3CA (0.61) | PIK3CAPIK3CBPIK3CGKDM4EMEN1 | |
| SCHEMBL6862405 | 0.57 | CA1 (0.36) | KMT2A |
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-2012041014-A1 | TETRACYCLIC INDOLE DERIVATIVES FOR TREATING HEPATITIS C VIRUS INFECTION | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |