Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 5/20 | 0.42 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709367 | 0.81 | MEN1 (0.46) | DPP4MEN1KMT2AHPGD | |
| SCHEMBL10033176 | 0.79 | L3MBTL1 (0.41) | DPP4POLBTSHRCYP1A2MEN1 | |
| SCHEMBL1709360 | 0.77 | L3MBTL1 (0.43) | MEN1KMT2AL3MBTL1JAK2JAK1 | |
| SCHEMBL1709472 | 0.74 | DGAT1 (0.39) | CYP2C9KDM1ARCOR1JAK2JAK1 | |
| SCHEMBL10032839 | 0.73 | KDM1A (0.40) | DPP4KDM1AL3MBTL1JAK2JAK1 | |
| SCHEMBL1709456 | 0.73 | ALDH1A1 (0.45) | POLBKMT2AKDM1ARCOR1HTR2A | |
| SCHEMBL22776971 | 0.69 | SMYD3 (0.44) | POLBCYP1A2MEN1KMT2AJAK2 | |
| SCHEMBL16211918 | 0.69 | DPP4 (0.61) | DPP4SLC9A1KDM1ARCOR1HTR2A | |
| SCHEMBL6917416 | 0.68 | MDM2 (0.48) | — | |
| SCHEMBL8144699 | 0.68 | DPP4 (0.66) | DPP4SLC9A1CYP1A2CYP3A4CYP2C9 |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |