Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN2 | Q9H2S1 | 4/20 | 0.51 |
| ▸ | KCNN3 | Q9UGI6 | 4/20 | 0.51 |
| ▸ | KCNN1 | Q92952 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 6/20 | 0.48 |
| ▸ | HTR2C | P28335 | 6/20 | 0.48 |
| ▸ | HTR2B | P41595 | 6/20 | 0.48 |
| ▸ | HTR1A | P08908 | 3/20 | 0.48 |
| ▸ | HTR7 | P34969 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | 0.88 | SLC18A2 (0.52) | KCNN2KCNN3KCNN1SLC18A2HTR2A | |
| SCHEMBL17864727 | 0.81 | KCNN2 (0.63) | KCNN2KCNN3KCNN1SLC18A2HTR2A | |
| SCHEMBL17864729 | 0.78 | KMT2A (0.54) | MAPTSLC18A2MAOAMAPK1 | |
| Hydrochloric Acid SCHEMBL9701984 | 0.74 | KCNN2 (0.52) | KCNN2KCNN3KCNN1MAPTMAOA | |
| SCHEMBL1201049 | 0.73 | SMN1; SMN2 (0.48) | MAPTKDM4EALDH1A1LMNA | |
| SCHEMBL17857157 | 0.72 | DRD2 (0.52) | MAPTKDM4EALDH1A1HSD17B10ALOX15 | |
| SCHEMBL16846561 | 0.72 | HTR2A (0.50) | KCNN2KCNN3KCNN1SLC18A2HTR2A | |
| SCHEMBL1159484 | 0.70 | RXFP1 (0.49) | MAPTTP53LMNA | |
| SCHEMBL14703859 | 0.70 | RAD52 (0.76) | SLC18A2 | |
| SCHEMBL14703855 | 0.70 | RAD52 (0.76) | SLC18A2 |
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 |