Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PAK1 | Q13153 | 6/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 3/20 | 0.41 |
| ▸ | RBP4 | P02753 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SUV39H1 | O43463 | 1/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4582099 | 0.94 | CYP1A2 (0.52) | CYP1A2CYP2D6PAK1TAS1R3TAS1R1 | |
| SCHEMBL4018965 | 0.89 | CYP1A2 (0.54) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4018993 | 0.84 | CYP1A2 (0.53) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4168703 | 0.84 | ALDH1A1 (0.51) | MEN1KMT2A | |
| SCHEMBL4018334 | 0.83 | TAS1R3 (0.46) | CYP1A2PAK1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL4019280 | 0.81 | CYP1A2 (0.54) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4023244 | 0.81 | CNR1 (0.57) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4024568 | 0.79 | PAK1 (0.68) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4024856 | 0.79 | PAK1 (0.67) | CYP1A2CYP2D6PAK1CNR1CNR2 | |
| SCHEMBL4020867 | 0.78 | CYP1A2 (0.55) | CYP1A2CYP2D6PAK1CNR1CNR2 |
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-2066654-A1 | N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS | Bayer Schering Pharma AG (DE) | 2009-06-10 | — | — | EP | disclosed |
| WO-2008028691-A1 | N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-03-13 | — | — | WO | disclosed |