Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.45 |
| ▸ | CAMK2D | Q13557 | 3/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 2/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.40 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.40 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.40 |
| ▸ | PRKCB | P05771 | 2/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8317092 | 1.00 | ROCK2 (0.45) | ROCK2CAMK2DABCG2CCNE1CDK2 | |
| Hydrochloric Acid SCHEMBL8319262 | 0.99 | ROCK2 (0.44) | ROCK2CAMK2DABCG2CCNE1CDK2 | |
| SCHEMBL8318394 | 0.96 | HTR6 (0.42) | ROCK2ABCG2MTNR1AMTNR1BHTR1D | |
| SCHEMBL8317078 | 0.91 | CAMK2D (0.48) | CAMK2DCDK4CCND1CAMK2BCAMK2G | |
| Hydrochloric Acid SCHEMBL8318720 | 0.90 | CAMK2D (0.48) | CAMK2DCDK4CCND1CAMK2BCAMK2G | |
| Hydrochloric Acid SCHEMBL8316493 | 0.86 | CAMK2D (0.42) | CAMK2DCCNE1CDK2CCNE2CDK4 | |
| SCHEMBL8314912 | 0.84 | PRKCB (0.42) | CAMK2DPRKCBPRKCAMEN1KMT2A | |
| SCHEMBL8316483 | 0.84 | CAMK2D (0.51) | CAMK2DPRKCBPRKCAGSK3BCHEK1 | |
| SCHEMBL8314832 | 0.82 | CAMK2D (0.43) | CAMK2DCDK4CCND1CAMK2BCAMK2G | |
| Hydrochloric Acid SCHEMBL8317707 | 0.81 | CAMK2D (0.42) | CAMK2DCDK4CCND1CAMK2BCAMK2G |
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 |
|---|---|---|---|---|---|---|---|
| EP-0925296-A1 | NEW PHARMACEUTICALLY ACTIVE COMPOUNDS | Astra Aktiebolag (SE) | 1999-06-30 | — | — | EP | disclosed |
| WO-1998011102-A1 | NEW PHARMACEUTICALLY ACTIVE COMPOUNDS | ASTRA AKTIEBOLAG (SE) | 1998-03-19 | — | — | WO | disclosed |