Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1531674 | 0.76 | PTGES (0.53) | ALDH1A1MEN1KMT2AKDM4EPTGES | |
| SCHEMBL25702598 | 0.67 | KMT2A (0.49) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL15858855 | 0.66 | ACE (0.39) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL15858922 | 0.66 | OGFRL1 (0.35) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL15858907 | 0.65 | OGFRL1 (0.46) | ATMALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL18088848 | 0.65 | OGFRL1 (0.46) | ATMALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL15858987 | 0.65 | HTR2A (0.38) | ALDH1A1LMNAHTTSMN1; SMN2MEN1 | |
| SCHEMBL15858986 | 0.65 | KCNH2 (0.45) | ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E | |
| SCHEMBL28091843 | 0.64 | TDP1 (0.65) | SMN1; SMN2MEN1KMT2APTGESCA12 | |
| SCHEMBL15858984 | 0.64 | OPRM1 (0.55) | — |
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-2014102590-A1 | SUBSTITUTED PIPERIDIN-4-AMINO-TYPE COMPOUNDS AND USES THEREOF | PURDUE PHARMA L.P. (US) | 2014-07-03 | — | — | WO | disclosed |