Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.76 |
| ▸ | MAPT | P10636 | 1/20 | 0.76 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.76 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.76 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.76 |
| ▸ | SOST | Q9BQB4 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.42 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Aminohippuric Acid SCHEMBL196513 | 0.87 | KDM4E (1.00) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| Aminohippuric Acid SCHEMBL31038605 | 0.85 | KDM4E (0.96) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL15227681 | 0.85 | KDM4E (0.54) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL176023 | 0.84 | KDM4E (0.53) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL18874371 | 0.82 | LMNA (0.49) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL17077349 | 0.81 | KDM4E (0.86) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| Aminohippuric Acid SCHEMBL10336340 | 0.78 | KDM4E (0.81) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| Aminohippuric Acid SCHEMBL27678715 | 0.78 | KDM4E (0.81) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL11107537 | 0.78 | KDM4E (0.80) | KDM4EMAPTHIF1ASLC22A6SLC22A8 | |
| SCHEMBL18837907 | 0.78 | HDAC2 (0.48) | KDM4EMAPTHIF1ASLC22A6SLC22A8 |
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-2012031298-A2 | ETHYNYLBENZENE DERIVATIVES | DUKE UNIVERSITY (US) | 2012-03-08 | — | — | WO | disclosed |