Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL5550991 | 0.80 | ALDH1A1 (0.42) | HRH3ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL3768285 | 0.77 | NOTUM (0.47) | HRH3ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL3773835 | 0.77 | ME2 (0.55) | HRH3ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL3765450 | 0.76 | NOTUM (0.50) | HRH3ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL3767922 | 0.76 | ALDH1A1 (0.44) | HRH3ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL3771811 | 0.76 | HRH3 (0.67) | HRH3ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL3768876 | 0.76 | KMT2A (0.56) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL3769953 | 0.75 | CYP2C9 (0.52) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3769769 | 0.75 | KDM4E (0.60) | HRH3ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL3766241 | 0.75 | NOTUM (0.47) | HRH3ALDH1A1KDM4EMAPTMEN1 |
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-7851474-B2 | Dipiperazinyl ketones and related analogues | NEUROGEN CORPORATION (US) | 2010-12-14 | — | — | US | disclosed |