Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PTPRB | P23467 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CPB1 | P15086 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27730485 | 0.87 | PTPRB (0.43) | POLBPKMLMNAPTPRBPTPN11 | |
| SCHEMBL17113510 | 0.85 | PKM (0.46) | POLBPKMLMNAPTPRBPTPN11 | |
| SCHEMBL3182707 | 0.84 | PTPRB (0.60) | PKMPTPRBPTPN11SMN1; SMN2MEN1 | |
| SCHEMBL13041438 | 0.83 | LMNA (0.42) | POLBPKMLMNAPTPRBPTPN11 | |
| SCHEMBL3731711 | 0.77 | JAK2 (0.49) | PKMPTPRBPTPN11SMN1; SMN2MEN1 | |
| SCHEMBL13041579 | 0.75 | PKM (0.44) | POLBPKMLMNASMN1; SMN2MEN1 | |
| SCHEMBL3734439 | 0.73 | PTPRB (0.55) | PKMLMNAPTPRBPTPN11MEN1 | |
| SCHEMBL28133350 | 0.72 | ALDH1A1 (0.55) | LMNASMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL27653429 | 0.71 | MEN1 (0.38) | POLBPKMLMNAPTPRBPTPN11 | |
| SCHEMBL28113207 | 0.71 | BCL2A1 (0.44) | SMN1; SMN2MEN1KMT2AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1909797-A2 | DIPIPERAZINYL KETONES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007016496-A2 | DIPIPERAZINYL KETONES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2007-02-08 | — | — | WO | disclosed |