Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4739273 | 0.82 | TUBB4A (0.45) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL4736651 | 0.80 | HTT (0.41) | SMN1; SMN2KMT2AHTTCYP2C19CYP1A2 | |
| SCHEMBL3931846 | 0.79 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL1448473 | 0.79 | CA1 (0.52) | SMN1; SMN2ALDH1A1KMT2AHTTCYP2C19 | |
| SCHEMBL28104657 | 0.77 | CA1 (0.50) | SMN1; SMN2ALDH1A1KMT2AHTTCYP2C19 | |
| SCHEMBL29561847 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL501900 | 0.76 | SMN1; SMN2 (0.55) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL4928556 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL348783 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB | |
| SCHEMBL583717 | 0.74 | POLB (0.52) | SMN1; SMN2ALDH1A1MAPK1GPBAR1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008070014-A2 | BIARYL KETONE-SUBSTITUTED PIPERIDINES | NEUROGEN CORPORATION (US) | 2008-06-12 | — | — | WO | disclosed |
| WO-2008070014-A2 | BIARYL KETONE-SUBSTITUTED PIPERIDINES | NEUROGEN CORPORATION (US) | 2008-06-12 | — | — | WO | disclosed |