Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.38 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CHKA | P35790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.31 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7657865 | 1.00 | HSD11B1 (0.43) | HSD11B1CHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL29525553 | 0.73 | MAPK1 (0.33) | CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL28193800 | 0.73 | NPSR1 (0.33) | CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL27874091 | 0.71 | TDP1 (0.34) | — | |
| SCHEMBL29433993 | 0.71 | NPSR1 (0.35) | CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL31408631 | 0.69 | NPSR1 (0.31) | — | |
| SCHEMBL14654230 | 0.64 | HSD11B1 (0.48) | HSD11B1CHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL27584019 | 0.64 | NPSR1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL21590494 | 0.63 | HSD11B1 (0.47) | HSD11B1CHRNB2CHRNA3CHRNA4CHRNB3 | |
| SCHEMBL937482 | 0.63 | CHRNB2 (0.55) | HSD11B1CHRNB2CHRNA3CHRNA4CHRNB3 |
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-6335343-B1 | IMIDAZOL-5-YLALKYLPIPERIZINE DERIVATIVES; ANTICARCINOGENIC AGENTS | MERCK & CO., INC. | 2002-01-01 | — | — | US | disclosed |