Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL1344422 | 0.85 | NR1H2 (0.44) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL19382853 | 0.85 | NR1H2 (0.44) | KDM4EMAPTTHRBHPGDDDB1 | |
| Hydrochloric Acid SCHEMBL9056008 | 0.83 | MAPT (0.43) | KDM4EMAPTTHRBHPGDGPR119 | |
| SCHEMBL9057632 | 0.80 | KDM4E (0.43) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL19420078 | 0.77 | MAPT (0.48) | KDM4EMAPTTHRBHPGDGPR119 | |
| SCHEMBL19420091 | 0.77 | MAPT (0.48) | KDM4EMAPTTHRBHPGDGPR119 | |
| SCHEMBL5765921 | 0.77 | MAPT (0.48) | KDM4EMAPTTHRBHPGDGPR119 | |
| SCHEMBL20438157 | 0.77 | KDM4E (0.42) | KDM4EMAPTTHRBHPGDDDB1 | |
| SCHEMBL17784898 | 0.75 | HPGD (0.53) | KDM4EMAPTTHRBHPGDGPR119 | |
| SCHEMBL190307 | 0.75 | MAPK1 (0.59) | KDM4EMAPTTHRBDDB1CRBN |
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-1996014844-A1 | CYCLIC AMIDINE ANALOGS AS INHIBITORS OF NITRIC OXIDE SYNTHASE | MERCK & CO., INC. (US) | 1996-05-23 | — | — | WO | disclosed |