Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 4/20 | 0.46 |
| ▸ | HRH1 | P35367 | 3/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.42 |
| ▸ | GALR2 | O43603 | 4/20 | 0.41 |
| ▸ | GALR1 | P47211 | 1/20 | 0.41 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3261263 | 0.79 | PIK3CA (0.46) | PIK3CAHRH1HRH4GALR2GALR1 | |
| SCHEMBL3421503 | 0.77 | PIK3CA (0.44) | PIK3CAHRH1HRH4GALR2GALR1 | |
| SCHEMBL13127052 | 0.72 | PIK3CA (0.55) | PIK3CAHRH1HRH4GALR2GALR1 | |
| SCHEMBL3451034 | 0.70 | PIK3CA (0.51) | PIK3CAHRH1HRH4GALR2GALR1 | |
| SCHEMBL3452006 | 0.69 | PIK3CA (0.53) | PIK3CAHRH1HRH4GALR2GALR1 | |
| SCHEMBL3452881 | 0.69 | IDH2 (0.53) | PIK3CAHPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL3264147 | 0.68 | NPY5R (0.45) | RAB9ATP53MAPTLMNAPOLB | |
| SCHEMBL3451806 | 0.67 | GALR2 (0.53) | PIK3CAGALR2GALR1HPGDMAPT | |
| SCHEMBL10144350 | 0.67 | GALR2 (0.72) | PIK3CAGALR2GALR1SMN1; SMN2MAPT | |
| SCHEMBL3221099 | 0.66 | PIK3CA (0.61) | PIK3CALMNAPOLBHSD17B10 |
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-2010028179-A1 | HETEROCYCLIC COMPOUNDS AS GATA MODULATORS | DR. REDDY'S LABORATORIES LTD. (IN) | 2010-03-11 | — | — | WO | disclosed |