Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 3/20 | 0.46 |
| ▸ | TCF7L2 | Q9NQB0 | 3/20 | 0.46 |
| ▸ | AURKA | O14965 | 3/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.42 |
| ▸ | VNN1 | O95497 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2419136 | 0.85 | P2RY2 (0.46) | CTNNB1TCF7L2KDM4EALDH1A1LMNA | |
| SCHEMBL4711129 | 0.84 | CTNNB1 (0.50) | CTNNB1TCF7L2AURKAVNN1RPS6KB1 | |
| SCHEMBL2412370 | 0.81 | ITK (0.47) | CTNNB1TCF7L2AURKAKDM4ECYP1A2 | |
| SCHEMBL2414062 | 0.79 | LRRK2 (0.46) | KDM4EHPGDSMN1; SMN2LRRK2THRB | |
| SCHEMBL2417626 | 0.78 | LRRK2 (0.51) | CTNNB1TCF7L2AURKAROCK2LRRK2 | |
| SCHEMBL2411619 | 0.76 | NR1H4 (0.45) | AURKAKDM4EALDH1A1TP53SMN1; SMN2 | |
| SCHEMBL2417872 | 0.76 | LMNA (0.48) | ALDH1A1LMNATP53TSHRROCK2 | |
| SCHEMBL2415985 | 0.75 | BDKRB1 (0.49) | KDM4EALDH1A1HPGDSMN1; SMN2TAS1R3 | |
| SCHEMBL2416104 | 0.75 | GRM5 (0.46) | ALDH1A1LMNATP53HPGDSMN1; SMN2 | |
| SCHEMBL2419957 | 0.75 | NPC1 (0.50) | KDM4ETP53TSHRSMN1; SMN2KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7786048-B2 | Condensed heterocyclic pyrazole derivatives as kinase inhibitors | PFIZER ITALIA S.R.L. (IT) | 2010-08-31 | — | — | US | disclosed |
| US-20090233813-A1 | Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors | PFIZER ITALIA S.R.L. (IT) | 2009-09-17 | — | — | US | disclosed |