Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 7/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | PRKCG | P05129 | 1/20 | 0.39 |
| ▸ | PRKCB | P05771 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | TOP2A | P11388 | 1/20 | 0.39 |
| ▸ | HEXA | P06865 | 1/20 | 0.39 |
| ▸ | HEXB | P07686 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1376936 | 0.79 | CDK4 (0.54) | ALDH1A1CDK4CCND1CCND2CCND3 | |
| SCHEMBL11559860 | 0.78 | MTOR (0.47) | KDM4ESMN1; SMN2MTORHTR2AHTR2C | |
| SCHEMBL11557301 | 0.78 | MTOR (0.38) | KDM4ESMN1; SMN2MTORTOP2AHEXA | |
| SCHEMBL9850735 | 0.74 | CNR2 (0.50) | KDM4EPOLBCDK4CCND1CCND2 | |
| SCHEMBL29712289 | 0.74 | BRD4 (0.50) | KDM4ESMN1; SMN2MTORTDP1KAT2B | |
| SCHEMBL2614748 | 0.74 | BRD4 (0.50) | KDM4ESMN1; SMN2MTORTDP1KAT2B | |
| SCHEMBL3892738 | 0.74 | HTR2A (0.57) | HTR6HTR2AHTR2CHTR7DRD3 | |
| SCHEMBL4142227 | 0.74 | PARP1 (0.37) | KDM4ESMN1; SMN2MTORTDP1ALDH1A1 | |
| SCHEMBL13657144 | 0.73 | KDM4E (0.49) | KDM4ESMN1; SMN2HTR6TOP2APDE4A | |
| SCHEMBL18691770 | 0.73 | PDE10A (0.51) | KDM4ESMN1; SMN2HTR6TOP2ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4133885-A | GASTRIC SECRETIONS INHIBITORS | MERCK & CO., INC. (US) | 1979-01-09 | — | — | US | claimed |