Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN2 | Q9H2S1 | 4/20 | 0.63 |
| ▸ | KCNN3 | Q9UGI6 | 4/20 | 0.63 |
| ▸ | KCNN1 | Q92952 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.54 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.54 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.54 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.54 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.54 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17864728 | 0.81 | SLC18A2 (0.52) | KCNN2KCNN3KCNN1SLC18A2HTR1A | |
| SCHEMBL17864726 | 0.81 | KCNN2 (0.51) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL13878183 | 0.79 | KCNN2 (0.76) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL26956109 | 0.79 | KCNN2 (0.59) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL3253219 | 0.78 | KCNN2 (0.94) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL3250242 | 0.78 | KCNN2 (1.00) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL3254146 | 0.77 | KCNN2 (1.00) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL3251892 | 0.77 | KCNN2 (0.91) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| Hydrochloric Acid SCHEMBL3248635 | 0.77 | KCNN2 (0.94) | KCNN2KCNN3KCNN1LMNAKDM4E | |
| SCHEMBL10722874 | 0.76 | KMT2A (0.77) | LMNAKDM4EALDH1A1HSD17B10MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016100391-A1 | 2-PHENETHENYLTETRAHYDRO ISOQUINOLINES USEFUL AS ANTI-HIV COMPOUNDS | Prosetta Antiviral, Inc. (US) | 2016-06-23 | — | — | WO | disclosed |